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Manchester Organics Ltd.

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Contact: Nichola Foote - Commercial Executive
Web: http://www.manchesterorganics.com
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Address: The Heath Business & Technical Park, Runcorn, Cheshire WA7 4QX, United Kingdom
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Profile: Manchester Organics Ltd. specializes in laboratory scale multi-step synthesis of a wide variety of organic compounds. Our client list includes many major pharmaceutical and chemical catalogue companies. As well as offering a range of fine organic intermediates, we also offer custom synthesis and a contract research service, undertaking projects tailored to the specific requirements of the customer, protected by confidentiality agreements where appropriate. We offer a comprehensive custom manufacturing service to the pharmaceutical and fine chemical industries. Custom synthesis projects are generally quoted at a fixed price with an estimate given of the likely timescale.

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• 1-Chloromethyl-4-Fluoro-1,4-Diazoniabicyclo[2.2.2]Octane Bis(Trifluoromethanesulfonate)
IUPAC Name: 1-(chloromethyl)-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane;trifluoromethanesulfonate | CAS Registry Number: 140681-68-1
Synonyms: 1-CHLOROMETHYL-4-FLUORO-1,4-DIAZONIABICYCLO[2.2.2]OCTANE BIS(TRIFLUOROMETHANESULFONATE), ACMC-20mzrn, AC1MCNHC, SCHEMBL9207212, CTK0H4196, MFCD01318126, AKOS005254455, AK402778, HE011636, I14-40415, 1-(Chloromethyl)-4-fluoro-1,4-diazabicyclo[2.2.2]octane-1,4-diium trifluoromethanesulfonate, 1-(CHLOROMETHYL)-4-FLUORO-1,4-DIAZONIABICYCLO[2.2.2]OCTANE BIS(TRIFLUOROMETHANESULFONATE)

Molecular Formula: C9H14ClF7N2O6S2Molecular Weight: 478.778 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 13

InChIKey: ZBNYOLKEKKOKCU-UHFFFAOYSA-L

• 2,6-Dimethyl-4-Pyridylmethanol
IUPAC Name: (2,6-dimethylpyridin-4-yl)methanol | CAS Registry Number: 18088-01-2
Synonyms: (2,6-dimethylpyridin-4-yl)methanol, SBB054788, AG-E-30980, 4-(Hydroxymethyl)-2,6-dimethylpyridine, AC1MY2EK, SureCN377724, CTK4D7743, 4-(Hydroxymethyl)-2,6-lutidine, MolPort-002-473-635, 4-Pyridinemethanol,2,6-dimethyl-, (2,6-dimethyl-4-pyridinyl)methanol, ANW-74719, ZINC05330589, AKOS005255193, (2,6-dimethyl-4-pyridyl)methan-1-ol, RP01129, 2,6-Dimethyl-4-(hydroxymethyl)pyridine, AK-33797, KB-00970, FT-0685540

Molecular Formula: C8H11NOMolecular Weight: 137.179040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DLDGHMPQNVTNRC-UHFFFAOYSA-N

• 1H,1H,2H,2H-Heptadecafluorodecyl Acrylate
IUPAC Name: 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl prop-2-enoate | CAS Registry Number: 27905-45-9
Synonyms: 474487_ALDRICH, 95475_FLUKA, EINECS 248-722-7, CID119747, 1H,1H,2H,2H-Perfluorodecyl acrylate, 1,1,2,2-Tetrahydroperfluorodecyl acrylate, 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl acrylate, 3S102785, 2-Propenoic acid, 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl ester, 120719-67-7, 141256-41-9, 470477-93-1

Molecular Formula: C13H7F17O2Molecular Weight: 518.166334 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 19

InChIKey: QUKRIOLKOHUUBM-UHFFFAOYSA-N

• 8-Amino-1,4-dioxaspiro[4.5]decane-8-carboxylic acid
IUPAC Name: 8-amino-1,4-dioxaspiro[4.5]decane-8-carboxylic acid | CAS Registry Number: 54621-18-0
Synonyms: 8-amino-1,4-dioxaspiro[4.5]decane-8-carboxylic Acid, SBB028414, 1-Amino-4-OxocyclohexanecarboxylicAcidEthyleneKetal, SureCN1811193, CTK1G9271, MolPort-001-770-215, AKOS005254696, AB16166, AG-A-92599, MCULE-4247632682, RP00156, KB-99625, KB-200260, FT-0678224, ST50825464, Y9424, C-6353, 4-AMINO-4-CARBOXYCYCLOHEXANONE ETHYLENE KETAL, 8-Amino-1,4-dioxaspiro[4.5]decane-8-carboxylicacid, 1,4-Dioxaspiro[4.5]decane-8-carboxylicacid, 8-amino-

Molecular Formula: C9H15NO4Molecular Weight: 201.219700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: HIIFALCQUKTUHB-UHFFFAOYSA-N

• 1-Phenylimidazolidin-2-One
IUPAC Name: 1-phenylimidazolidin-2-one | CAS Registry Number: 1848-69-7
Synonyms: 1-Phenyl-2-imidazolidinone, AmbTiP32002, 1-Phenylimidazolidin-2-one, 2-Imidazolidinone, 1-phenyl-, 3-Phenyl-2-imidazolidinone, NCIOpen2_000752, NSC80633, MolPort-000-005-964, CID255273, ZINC00408080, GL-0292, P32002

Molecular Formula: C9H10N2OMolecular Weight: 162.188500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: QKKGTRSHKSWYAK-UHFFFAOYSA-N

• (R)-3-amino-2,3,4,5-tetrahydro-1H-benzazepin-2-one
IUPAC Name: (3R)-3-amino-1,3,4,5-tetrahydro-1-benzazepin-2-one | CAS Registry Number: 137036-55-6
Synonyms: (R)-3-Amino-2,3,4,5-tetrahydro-1H-1-benzazepin-2-one, (R)-3-amino-4,5-dihydro-1H-benzo[b]azepin-2(3H)-one, (R)-3-amino-2-Oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepine, PubChem16168, SureCN1269652, 2H-1-Benzazepin-2-one,3-amino-1,3,4,5-tetrahydro-, (3R)-, CTK4C0607, WTI-10259, AKOS005257342, AKOS006271746, AG-D-75416, RP23795, KB-03161, A807174, I14-32575, (3R)-3-amino-1,3,4,5-tetrahydro-1-benzazepin-2-one, (3R)-3-azanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one, 2H-1-Benzazepin-2-one,3-amino-1,3,4,5-tetrahydro-, (R)-; (+)-a-Aminotetrahydro-2-benzazepinone; (R)-3-Amino-2,3,4,5-tetrahydro-1H-1-benzazepin-2-one

Molecular Formula: C10H12N2OMolecular Weight: 176.215080 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: AUAKXRGQXZRTQC-MRVPVSSYSA-N

• 2-Chloro-4-(hydroxymethyl)pyridine
IUPAC Name: (2-chloropyridin-4-yl)methanol | CAS Registry Number: 100704-10-7
Synonyms: MLS000582507, (2-chloropyridin-4-yl)methanol, ZINC03883974, CID7062237, SMR000206493, 4Y-0721

Molecular Formula: C6H6ClNOMolecular Weight: 143.570940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UDDVPFLXGOBESH-UHFFFAOYSA-N

• 1-(2-Thienyl)ethylamine
IUPAC Name: 1-thiophen-2-ylethanamine | CAS Registry Number: 6309-16-6
Synonyms: 1-thien-2-ylethanamine, 1-Thiophen-2-yl-ethylamine, 1-(thiophen-2-yl)ethanamine, NSC42522, MolPort-001-756-568, ALBB-000031, CID238233, STK042285, GL-0327, T80187, T5440601

Molecular Formula: C6H9NSMolecular Weight: 127.207360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LYJBVRVJQXVVPI-UHFFFAOYSA-N

• 1-(4-chlorophenyl)-1H-pyrrole
IUPAC Name: 1-(4-chlorophenyl)pyrrole | CAS Registry Number: 5044-38-2
Synonyms: 1-(4-Chlorophenyl)pyrrole, ChemDiv2_003440, Pyrrole, 1-(p-chlorophenyl)-, Maybridge1_002870, 1-(4-Chlorophenyl)-1H-pyrrole, 1H-Pyrrole, 1-(4-chlorophenyl)-, DivK1c_001622, 452947_ALDRICH, NB-178, NSC116796, AIDS126596, AIDS-126596, CID272425, ZINC00138294, NSC 116796, CDS1_000582, ST5405918, EU-0032749, InChI=1/C10H8ClN/c11-9-3-5-10(6-4-9)12-7-1-2-8-12/h1-8

Molecular Formula: C10H8ClNMolecular Weight: 177.630220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LTOQUFIOYDCJFJ-UHFFFAOYSA-N

• (phenylthio)propanone
IUPAC Name: 1-phenylsulfanylpropan-2-one | CAS Registry Number: 5042-53-5
Synonyms: ghl.PD_Mitscher_leg0.697, 1-phenylsulfanyl-propan-2-one, NSC60970, CID247129, ZINC01690590, BBV-27095869

Molecular Formula: C9H10OSMolecular Weight: 166.240100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: XREBEJBUPRGGTB-UHFFFAOYSA-N

• 18-Crown-6 (1,4,7,10,13,16-Hexanoxacyclo-Octadecane)
IUPAC Name: 3,6,9,12,15,18-hexaoxacyclooctadecane | CAS Registry Number: 17455-13-9
Synonyms: 18-Crown-6, Ethylene oxide cyclic hexamer, 18-Crown-6 ether, Hexaoxacyclooctadecane, CCRIS 3587, 33003U_SUPELCO, 1,4,7,10,13,16-HEXAOXACYCLOOCTADECANE, 186651_ALDRICH, 274984_ALDRICH, 07673_FLUKA, CHEBI:32397, EINECS 241-473-5, NSC 159836, BRN 1619616, 1,4,7,10,13,16-Hexanoxacyclooctadecane, NSC159836, ZINC03861356, WLN: T-18-O DO GO JO MO POTJ, LS-75505, ST023795

Molecular Formula: C12H24O6Molecular Weight: 264.315360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: XEZNGIUYQVAUSS-UHFFFAOYSA-N

• 1H-Indazole, 1-methyl-6-nitro-
IUPAC Name: 1-methyl-6-nitroindazole | CAS Registry Number: 6850-23-3
Synonyms: Oprea1_471590, 1-Methyl-6-nitro-1H-indazole, NSC131654, ZINC01719161, BB-0836, NSC 131654

Molecular Formula: C8H7N3O2Molecular Weight: 177.160080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: TUWHJYXETJCCPJ-UHFFFAOYSA-N

• 1,3-Dibromoacetone
IUPAC Name: 1,3-dibromopropan-2-one | CAS Registry Number: 816-39-7
Synonyms: sGQDLLRxbRwSP@, Lithium diethylamide, 1,3-Dibromo-2-propanone, 2-Propanone, 1,3-dibromo-, 1,3-dibromopropan-2-one, 13-DIBROMOPROPAN-2-ONE, CID69952, EINECS 212-430-8, NSC249810, 1,3-DIBROMO ACETONE (SYM.), NSC 249810

Molecular Formula: C3H4Br2OMolecular Weight: 215.871260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LQQKDSXCDXHLLF-UHFFFAOYSA-N

• 1-(4-(4-Aminophenyl)piperazin-1-Yl)ethanone
IUPAC Name: 1-[4-(4-aminophenyl)piperazin-1-yl]ethanone | CAS Registry Number: 92394-00-8
Synonyms: TimTec1_007041, Oprea1_693361, MLS002264484, BB_SC-0417, 4-(4-Acetyl-1-piperazinyl)aniline, CID736269, STK029286, ZINC00156781, BAS 06839509, SDCCGMLS-0064968.P001, SMR001317784, UX00004624, 1-[4-(4-aminophenyl)piperazin-1-yl]ethanone, 1-[4-(4-Amino-phenyl)-piperazin-1-yl]-ethanone

Molecular Formula: C12H17N3OMolecular Weight: 219.282880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: AFVUJJNEILZYJQ-UHFFFAOYSA-N

• 1-Butylboronic Acid
IUPAC Name: butylboronic acid | CAS Registry Number: 4426-47-5
Synonyms: 1-Butaneboronic acid, Propylboronic acid, BUTYLBORONIC ACID, n-Butylboronic acid, 1-Butyldihydroxyborane, 1-BUTANE BORONIC ACID, 163244_ALDRICH, 19667_FLUKA, EINECS 224-607-7, DB02664, TL8003084, InChI=1/C4H11BO2/c1-2-3-4-5(6)7/h6-7H,2-4H2,1H

Molecular Formula: C4H11BO2Molecular Weight: 101.939940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: QPKFVRWIISEVCW-UHFFFAOYSA-N

• 1-(3-Pyridyl)ethan-1-One Oxime
IUPAC Name: (NE)-N-(1-pyridin-3-ylethylidene)hydroxylamine | CAS Registry Number: 5973-83-1
Synonyms: 3-Acetylpyridine oxime, WLN: T6NJ CY1&UNQ, 1-Pyridin-3-yl-ethanone oxime, Ethanone, 1-(3-pyridinyl)-, oxime, KETONE, METHYL 3-PYRIDYL, OXIME, STOCK1S-64936, NSC 72375, NSC72375, BRN 0114168, ZINC12356952, CID5708334, LS-87320, Ethanone, 1-(3-pyridinyl)-, oxime (9CI), P67448, 5-21-07-00395 (Beilstein Handbook Reference)

Molecular Formula: C7H8N2OMolecular Weight: 136.151220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MSRXORUOQNNOKN-RMKNXTFCSA-N

• 2-N-Butyrylthiophene
IUPAC Name: 1-thiophen-2-ylbutan-1-one | CAS Registry Number: 5333-83-5
Synonyms: 2-Butyrylthiophene, Ketone, propyl 2-thienyl, 1-Butanone, 1-(2-thienyl)-, 1-thien-2-ylbutan-1-one, 1-(2-Thienyl)butan-1-one, NSC2350, 1-Thiophen-2-yl-butan-1-one, 1-(thiophen-2-yl)butan-1-one, ALBB-002873, CID79248, EINECS 226-246-0, STK502524, ZINC00394340, BBV-5097148, AI3-13195, T60009

Molecular Formula: C8H10OSMolecular Weight: 154.229400 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: YXHIINNJOGKPLF-UHFFFAOYSA-N

• 1,2-Epoxy-9-Decene
IUPAC Name: 2-oct-7-enyloxirane | CAS Registry Number: 85721-25-1
Synonyms: Oct-7-enyloxirane, (7-Octenyl)oxirane, 2-(7-Octenyl)oxirane, 1,2-Epoxy-9-decene, Oxirane, (7-octenyl)-, 410829_ALDRICH, EINECS 288-437-5, CID543758, ZINC02569686

Molecular Formula: C10H18OMolecular Weight: 154.249320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FCZHJHKCOZGQJZ-UHFFFAOYSA-N

• 1-Pyridin-4-Yl-Ethanol
IUPAC Name: 1-pyridin-4-ylethanol | CAS Registry Number: 23389-75-5
Synonyms: 1-(4-Pyridyl)ethanol, ()-1-(4-Pyridyl)ethanol, 82904_ALDRICH, alpha-Methylpyridine-4-methanol, 82904_FLUKA, EINECS 245-630-9, AKE-BBV-142536, (+/-)-1-(4-Pyridyl)ethanol, 4-Pyridinemethanol, alpha-methyl-, ()-alpha-Methyl-4-pyridinemethanol, CID90919, BBV-142536, GL-0159, (+/-)-alpha-Methyl-4-pyridinemethanol, InChI=1/C7H9NO/c1-6(9)7-2-4-8-5-3-7/h2-6,9H,1H

Molecular Formula: C7H9NOMolecular Weight: 123.152460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: HVOAMIOKNARIMR-UHFFFAOYSA-N

• (5-Methyl-3-Phenylisoxazol-4-Yl)methanol
IUPAC Name: (5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol | CAS Registry Number: 18718-79-1
Synonyms: (5-METHYL-3-PHENYLISOXAZOL-4-YL)METHANOL, (5-methyl-3-phenyl-4-isoxazolyl)methanol, (5-methyl-3-phenyl-1,2-oxazol-4-yl)methanol, AG-E-36242, ZINC00158498, PubChem8424, AC1MCQR3, SureCN107436, AC1Q2FC5, CTK4D9438, MolPort-000-142-141, ACT07578, ANW-58495, SBB090948, AKOS005255134, AG-A-05918, CC00509, RP03652, SDCCGMLS-0065904.P001, 4-Isoxazolemethanol,5-methyl-3-phenyl-

Molecular Formula: C11H11NO2Molecular Weight: 189.210540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GHGWDZCXZRWQBG-UHFFFAOYSA-N

• 3,3-Diphenyltetrahydrofuran-2-ylidene(dimethyl)ammonium bromide
IUPAC Name: (3,3-diphenyloxolan-2-ylidene)-dimethylazanium | CAS Registry Number: 37743-18-3
Synonyms: ZINC02389343, CID2723590

Molecular Formula: C18H20NO+Molecular Weight: 266.357500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LFTJLBZHKDXXBN-UHFFFAOYSA-N

• 1,3-Hexadiene
IUPAC Name: (3E)-hexa-1,3-diene | CAS Registry Number: 592-48-3
Synonyms: 1,3-Hexadiene,c&t, 1,trans-3-hexadiene, trans-1,3-Hexadiene, C2H5CH=CHCH=CH2, (E)-1,3-Hexadiene, cis,trans-Hexa-1,3-diene, 1,3-Hexadiene, (E)-, CID39175, EINECS 209-759-4, 20237-34-7

Molecular Formula: C6H10Molecular Weight: 82.143600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: AHAREKHAZNPPMI-AATRIKPKSA-N

• 1-Boc-3-benzyl-piperazine
IUPAC Name: tert-butyl 3-benzylpiperazine-1-carboxylate | CAS Registry Number: 502649-29-8
Synonyms: 1-Boc-3-Benzylpiperazine, tert-Butyl 3-Benzylpiperazine-1-carboxylate, N-1-Boc-3-benzyl piperizine, SBB056138, AG-F-68774, SureCN2943387, 1-N-BOC-3-BENZYL, CTK4J2331, MolPort-003-985-771, N-BOC-3-BENZYL PIPERAZINE, ACT09779, 1-N-BOC-3-BENZYL PIPERAZINE, ANW-57892, N-1-BOC-3-BENZYL-PIPERAZINE, RW3459, AKOS005255250, AB31241, AC-2222, QC-1976, RP06576

Molecular Formula: C16H24N2O2Molecular Weight: 276.373960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YFIAVMMGSRDLLG-UHFFFAOYSA-N

• 3-Aminocarbonyl-1-Boc-Pyrrolidine
IUPAC Name: tert-butyl 3-carbamoylpyrrolidine-1-carboxylate | CAS Registry Number: 122684-34-8
Synonyms: 3-Aminocarbonyl-1-Boc-pyrrolidine, 1-Boc-pyrrolidine-3-carboxyamide, CID4571096, TL8000606, LT03382195, A40500, Tert-butyl 3-carbamoylpyrrolidine-1-carboxylate

Molecular Formula: C10H18N2O3Molecular Weight: 214.261520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NHDGOVOBEZPXMY-UHFFFAOYSA-N

• 1-Methyl-4-(perfluoroethyl)benzene
IUPAC Name: 1-methyl-4-(1,1,2,2,2-pentafluoroethyl)benzene | CAS Registry Number: 117081-46-6
Synonyms: 1-Methyl-4-(pentafluoroethyl)benzene, Benzene,1-methyl-4-(1,1,2,2,2-pentafluoroethyl)-, ACMC-1BWFD, AGN-PC-000FQE, CTK4B0142, AKOS005256020, AG-D-38848, Benzene, 1-methyl-4-(pentafluoroethyl)-, FT-0678822, 1-methyl-4-(1,1,2,2,2-pentafluoro-ethyl)-benzene, I01-13709, Benzene,1-methyl-4-(pentafluoroethyl)- (9CI); 1-Methyl-4-(perfluoroethyl)benzene

Molecular Formula: C9H7F5Molecular Weight: 210.143896 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: GNYDVGCKILRJRP-UHFFFAOYSA-N

• 1,4-Dichloro-2-Butyne
IUPAC Name: 1,4-dichlorobut-2-yne | CAS Registry Number: 821-10-3
Synonyms: 1,4-Dichlorobutyne, 1,4-DICHLORO-2-BUTYNE, 2-Butyne, 1,4-dichloro-, 1,4-Dichlorobut-2-yne, WLN: G2UU2G, D59607_ALDRICH, NSC30603, 35600_FLUKA, EINECS 212-474-8, NSC 30603, CID13182, BRN 0635740, OR5528, AI3-26930, FR-0128, LS-47473, TL8005441, 4-01-00-00973 (Beilstein Handbook Reference)

Molecular Formula: C4H4Cl2Molecular Weight: 122.980560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: RCHDLEVSZBOHOS-UHFFFAOYSA-N

• 2,4-Bis(trifluoromethyl)bromobenzene
IUPAC Name: 1-bromo-2,4-bis(trifluoromethyl)benzene | CAS Registry Number: 327-75-3
Synonyms: Ambap5059, 330388_ALDRICH, JRD-0063, 1-Bromo-2,4-bis(trifluoromethyl)benzene, 4-Bromo-1,3-bis(trifluoromethyl)benzene, TL8002469

Molecular Formula: C8H3BrF6Molecular Weight: 293.003839 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: QDEJWLIKRLJYEK-UHFFFAOYSA-N

• 1h-Indazole-5-Boronic Acid
IUPAC Name: 1H-indazol-5-ylboronic acid | CAS Registry Number: 338454-14-1
Synonyms: 1H-Indazole-5-boronic acid, 1H-indazol-5-ylboronic acid, Indazole-5-boronic acid, 1H-Indazol-5-yl-5-boronic acid, AG-F-14429, 5-Borono-1H-indazole, PubChem23544, ACMC-1ACMP, SureCN23786, SureCN481818, AGN-PC-01LR8A, 5-INDAZOLYBORONIC ACID, BA09, INDAZOL-5-YLBORONIC ACID, CTK4H1322, Boronic acid,B-1H-indazol-5-yl-, ACT04823, Boronic acid, B-1H-indazol-5-yl-, ANW-27713, WTI-10413

Molecular Formula: C7H7BN2O2Molecular Weight: 161.953680 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: CLVPGJWAMIADSY-UHFFFAOYSA-N

• 1-Fluoro-4-(Trifluoromethylthio)Benzene
IUPAC Name: 1-fluoro-4-(trifluoromethylsulfanyl)benzene | CAS Registry Number: 940-76-1
Synonyms: ZINC04334553, 4-Fluorophenyl trifluoromethyl sulphide, CID136758, LT03382915

Molecular Formula: C7H4F4SMolecular Weight: 196.165273 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: BTKQCAUEXFTVNT-UHFFFAOYSA-N

• 1,5-Bis-(2-Thienyl)-1,4-Pentadien-3-One
IUPAC Name: 1,5-dithiophen-2-ylpenta-1,4-dien-3-one | CAS Registry Number: 886-78-2
Synonyms: 1,5-di(2-thienyl)penta-1,4-dien-3-one, 1,5-Bis-(2-thienyl)-1,4-pentadien-3-one, AC1LEJTS, Bionet2_001342, SureCN5598744, CTK5G1202, AG-H-58587, MCULE-9958166862, 1,4-Pentadien-3-one,1,5-di-2-thienyl-, KB-151016, 1,5-dithiophen-2-ylpenta-1,4-dien-3-one, 1,5-Bis(2-thienyl)penta-1,4-dien-3-one;1,5-Di-2-thienyl-1,4-pentadien-3-one

Molecular Formula: C13H10OS2Molecular Weight: 246.347900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: IWLDEULFZPGROA-UHFFFAOYSA-N

• 4-Fluoro benzyl mercaptan
IUPAC Name: (4-fluorophenyl)methanethiol | CAS Registry Number: 15894-04-9
Synonyms: 4-Fluorobenzyl mercaptan, p-Fluorotoluene-alpha-thiol, Benzenemethanethiol, 4-fluoro-, 539155_ALDRICH, EINECS 240-031-9, ZINC00404004, BBV-058333, TL8006767

Molecular Formula: C7H7FSMolecular Weight: 142.193883 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RKTRHMNWVZRZJQ-UHFFFAOYSA-N

• 2-Chloro-4-Methoxybenzylbromide
IUPAC Name: 1-(bromomethyl)-2-chloro-4-methoxybenzene | CAS Registry Number: 54788-17-9
Synonyms: 2-chloro-4-methoxybenzylbromide, 1-(bromomethyl)-2-chloro-4-methoxybenzene, 1-BROMOMETHYL-2-CHLORO-4-METHOXYBENZENE, AG-F-91068, ACMC-1B0CB, SureCN473882, KSC497O5L, BEN522, CTK3J7755, 2-Chloro-4-Methoxybenzyl Bromide, MolPort-003-991-776, ACT03534, ANW-74182, ZINC12359133, AKOS005258516, AM84063, AK-80052, KB-11807, FT-0081575, FT-0651184

Molecular Formula: C8H8BrClOMolecular Weight: 235.505520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: UIOYCWAQKOLSMA-UHFFFAOYSA-N

• 3-(Perfluoro-N-Octyl)propenoxide
IUPAC Name: 2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)oxirane | CAS Registry Number: 38565-53-6
Synonyms: 474088_ALDRICH, EINECS 254-006-5, 3-(Perfluoro-n-octyl)propenoxide, CID571982, (2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-Heptadecafluorononyl)oxirane, Oxirane, (2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)-

Molecular Formula: C11H5F17OMolecular Weight: 476.129654 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 18

InChIKey: HMXSIEIEXLGIET-UHFFFAOYSA-N

• 1-(Trifluoromethyl)cyclopentane-1-Carboxylic Acid
IUPAC Name: 1-(trifluoromethyl)cyclopentane-1-carboxylic acid | CAS Registry Number: 277756-44-2
Synonyms: 1-(Trifluoromethyl)cyclopentane-1-carboxylic acid, 1-(trifluoromethyl)cyclopentanecarboxylic acid, Cyclopentanecarboxylicacid, 1-(trifluoromethyl)-, ACMC-1CP3T, AC1Q71ZH, AGN-PC-00PH7Y, SureCN1786525, CTK1A0639, MolPort-003-991-766, MAY00118, SBB089870, AKOS005254509, AG-E-88697, RP03263, KB-09698, 1-Trifluoromethylcyclopentanecarboxylicacid;, 1-Trifluoromethyl-cyclopentanecarboxylic acid, FT-0677961, Y8536, EN300-88142

Molecular Formula: C7H9F3O2Molecular Weight: 182.140370 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: DGQRYPPBAJNZFZ-UHFFFAOYSA-N

• 1,2,3,4-Tetrahydro-1-naphthoic acid
IUPAC Name: 1,2,3,4-tetrahydronaphthalene-1-carboxylic acid | CAS Registry Number: 1914-65-4
Synonyms: 1,2,3,4-tetrahydronaphthalene-1-carboxylic acid, 1,2,3,4-Tetrahedro-naphthoic acid, SBB065730, 1,2,3,4-tetrahydro-1-naphthalenecarboxylic acid, 1,2,3,4-tetrahydronaphthalenecarboxylic acid, (S)-1,2,3,4-tetrahydro-naphthoic acid, ACMC-209ev1, SureCN242244, Tetralin-1-carboxylic Acid, AC1Q74FO, CHEMBL81606, Jsp003930, 1-TETRALINCARBOXYLIC ACID, CTK0H4340, CHEBI:228620, MolPort-001-572-843, ACT02790, ANW-23531, WTI-10513, AKOS001452907

Molecular Formula: C11H12O2Molecular Weight: 176.211780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VDLWTJCSPSUGOA-UHFFFAOYSA-N

• (1S,5R)-7-Oxo-6-Oxa-2-Azabicyclo[3.2.1]octane-2-Carboxylic Acid 1,1-Dimethylethyl Ester
IUPAC Name: tert-butyl (1R,5S)-6-oxo-7-oxa-4-azabicyclo[3.2.1]octane-4-carboxylate | CAS Registry Number: 175476-93-4
Synonyms: (1S,5R)-tert-Butyl 7-oxo-6-oxa-2-azabicyclo[3.2.1]octane-2-carboxylate, AKOS005256588, AK167384, DB-065102, (1S,5R)-7-oxo-6-Oxa-2-azabicyclo[3.2.1]octane-2-carboxylic acid 1,1-dimethylethyl ester

Molecular Formula: C11H17NO4Molecular Weight: 227.256980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: GOFMUSYMHNTSDS-SFYZADRCSA-N

• 1,4-Butane diisothiocyanate
IUPAC Name: 1,4-diisothiocyanatobutane | CAS Registry Number: 4430-51-7
Synonyms: 1,4-Diisothiocyanatobutane

Molecular Formula: C6H8N2S2Molecular Weight: 172.271120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RRSISCMPUAGVJN-UHFFFAOYSA-N

• 1-(Trifluoromethyl)cyclohexane-1-Carboxylic Acid
IUPAC Name: 1-(trifluoromethyl)cyclohexane-1-carboxylic acid | CAS Registry Number: 180918-40-5
Synonyms: 1-(Trifluoromethyl)cyclohexane-1-carboxylic acid, 1-(trifluoromethyl)cyclohexanecarboxylic acid, Cyclohexanecarboxylicacid, 1-(trifluoromethyl)-, ACMC-20ap98, SureCN696271, AGN-PC-00PH7X, AC1Q720A, CTK0H3339, MolPort-003-991-785, MAY00136, SBB091971, AKOS005254781, AG-A-16108, AG-L-62996, RP04033, 1-Trifluoromethylcyclohexanecarboxylicacid, 1-Trifluoromethyl-cyclohexanecarboxylic acid, FT-0081296, FT-0651090, Y8048

Molecular Formula: C8H11F3O2Molecular Weight: 196.166950 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: VFSFTDFBHSFDEE-UHFFFAOYSA-N

• 1,3-dichloroisoquinoline
IUPAC Name: 1,3-dichloroisoquinoline | CAS Registry Number: 7742-73-6
Synonyms: 1,3-Dichloro-isoquinoline, isoquinoline, 1,3-dichloro-, 368830_ALDRICH, NSC170843, SBB003563, ZINC00331717, UX00003652, AC-907/25014223, InChI=1/C9H5Cl2N/c10-8-5-6-3-1-2-4-7(6)9(11)12-8/h1-5

Molecular Formula: C9H5Cl2NMolecular Weight: 198.048700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BRGZEQXWZWBPJH-UHFFFAOYSA-N

• 1-(Trifluoromethyl)cyclopropane-1-Carboxylic Acid Methyl Ester
IUPAC Name: methyl 1-(trifluoromethyl)cyclopropane-1-carboxylate | CAS Registry Number: 208242-25-5
Synonyms: Methyl 1-(trifluoromethyl)cyclopropane-1-carboxylate, ST50407545, Methyl 1-Trifluoromethyl-1-Cyclopropanecarboxylate, 1-(Trifluoromethyl)cyclopropane-1-carboxylic acid methyl ester, methyl 1-(trifluoromethyl)cyclopropanecarboxylate, ACMC-1CJ3I, SureCN978083, CTK3J6376, MolPort-001-771-629, SBB088136, ZINC12359083, AKOS005254495, AG-B-26349, MCULE-9876849658, RP02552, KB-83676, FT-0677559, Y8205, I04-4964

Molecular Formula: C6H7F3O2Molecular Weight: 168.113790 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: PAWUSHZXEZPDBE-UHFFFAOYSA-N

• 1-(5-Iodopyridin-2-yl)piperazine
IUPAC Name: 1-(5-iodopyridin-2-yl)piperazine | CAS Registry Number: 219635-89-9
Synonyms: Ambad108, 1-(5-Iodo-pyridin-2-yl)-piperazine

Molecular Formula: C9H12IN3Molecular Weight: 289.116150 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MKKJIJFTSAYHBW-UHFFFAOYSA-N

• 1-Bromo-3-Bromomethyl-2-Fluorobenzene
IUPAC Name: 1-bromo-3-(bromomethyl)-2-fluorobenzene | CAS Registry Number: 149947-16-0
Synonyms: 1-Bromo-3-(bromomethyl)-2-fluorobenzene, 1-Bromo-3-bromomethyl-2-fluorobenzene, 3-Bromo-2-fluorobenzyl bromide, Benzene,1-bromo-3-(bromomethyl)-2-fluoro-, ACMC-20ahso, SureCN376927, CTK4C6440, MAY00216, ANW-73990, CL9073, AKOS005255254, AG-D-96398, RP06442, AK-89754, KB-70506, FT-0678620, Y7589, I01-12648

Molecular Formula: C7H5Br2FMolecular Weight: 267.921003 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MGVHFTWDCYIBDO-UHFFFAOYSA-N

• (S)-(-)-2-Methyl-2-propanesulfinamide
IUPAC Name: 2-methylpropane-2-sulfinamide | CAS Registry Number: 343338-28-3
Synonyms: (s)-2-methylpropane-2-sulfinamide, (S)-(-)-tert-Butanesulfinamide, (S)-(-)-t-Butylsulfinamide, (S)-(-)-tert-Butylsulfinamide, (s)-2-methyl-2-propanesulfinamide, (S)-tert-butanesulfinamide, (R)-tert-Butanesulfinamide, (r)-2-methylpropane-2-sulfinamide, PubChem6057, s-tert-butylsulfinamide, KSC222E9D, (s)-(-)-t-butyl sulfinamide, 513210_ALDRICH, Jsp002696, Ambap146374-27-8, CTK1C2291, (S)-(-)-tert-Butyl sulfinamide, MolPort-002-501-425, (s)-(-)-tert-butyl sulphinamide, ACN-S003974

Molecular Formula: C4H11NOSMolecular Weight: 121.201240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CESUXLKAADQNTB-ZETCQYMHSA-N

• (±)-2,2,2-Trifluoro-1-Pyridin-3-Ylethylamine Hydrochloride
IUPAC Name: 2,2,2-trifluoro-1-pyridin-3-ylethanamine;hydrochloride | CAS Registry Number: 1138011-22-9
Synonyms: 2,2,2-trifluoro-1-(pyridin-3-yl)ethanamine hydrochloride, 2,2,2-Trifluoro-1-pyridin-3-ylethylamine hydrochloride, 2,2,2-TRIFLUORO-1-PYRIDIN-3-YL-ETHYLAMINE HYDROCHLORIDE, 336105-46-5, ACMC-20aokz, CTK7D4228, AKOS005255724, AB28542, AG-L-41891, AK-55796, A821871, 2,2,2-trifluoro-1-(3-pyridinyl)ethanamine hydrochloride, 2,2,2-TRIFLUORO-1-(3-PYRIDYL)ETHYLAMINE HYDROCHLORIDE, 2,2,2-tris(fluoranyl)-1-pyridin-3-yl-ethanamine hydrochloride, 2,2,2-TRIFLUORO-1-(3-PYRIDINYL)ETHYLAMINE HYDROCHLORIDE, 2,2,2-TRIFLUORO-1-PYRIDIN-3-YL-ETHYL-AMMONIUM, CHLORIDE, ALPHA-(TRIFLUOROMETHYL)-3-PYRIDINEMETHANAMINEHYDROCHLORIDE, (+/-)-2,2,2-TRIFLUORO-1-PYRIDIN-3-YLETHYLAMINE HYDROCHLORIDE, (S)-2,2,2-TRIFLUORO-1-PYRIDIN-3-YL-ETHYLAMINE HYDROCHLORIDE

Molecular Formula: C7H8ClF3N2Molecular Weight: 212.600030 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: NLDVAGWIUPSGQC-UHFFFAOYSA-N

• (2,2-Difluorocyclopropyl)methanol
IUPAC Name: (2,2-difluorocyclopropyl)methanol | CAS Registry Number: 509072-57-5
Synonyms: 2,2-Difluorocyclopropylmethanol, (2,2-difluorocyclopropyl)methanol, sOqDFIARBSWxuUP@, SureCN21904, AC1MC4V4, 2,2-Difluorocyclopropyl methanol, CTK4J3333, MolPort-000-160-066, (2,2-difluorocyclopropyl)-methanol, ACN-S002741, AKOS005254700, AG-F-71604, AK-35386, KB-163857, A7539, FT-0649669, X8433, I14-29635

Molecular Formula: C4H6F2OMolecular Weight: 108.086646 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XOLSMTBBIZDHSG-UHFFFAOYSA-N

• 1-Methyl-4-Phenyl-3-(trifluoromethyl)-1H-Pyrazol-5-Amine
IUPAC Name: 2-methyl-4-phenyl-5-(trifluoromethyl)pyrazol-3-amine | CAS Registry Number: 63156-74-1
Synonyms: 1-methyl-4-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-amine, 2-methyl-4-phenyl-5-(trifluoromethyl)pyrazol-3-amine, ZINC00110577, AC1MCCR3, Maybridge3_006672, MLS000860260, CTK5B7835, MolPort-000-146-433, HMS1449P06, HMS2807G24, SEW04679, SBB099419, AKOS005256220, AG-G-33737, IDI1_018059, KB-66349, SMR000461039, I14-93954, 1-methyl-4-phenyl-3-(trifluoromethyl)pyrazole-5-ylamine, 5-Amino-1-methyl-4-phenyl-3-(trifluoromethyl)-1H-pyrazole

Molecular Formula: C11H10F3N3Molecular Weight: 241.212410 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: KCCKFLAAEZFOPE-UHFFFAOYSA-N

• 1-Benzoylpiperazine
IUPAC Name: phenyl(piperazin-4-ium-1-yl)methanone | CAS Registry Number: 13754-38-6
Synonyms: ZINC00235748, CID5068051

Molecular Formula: C11H15N2O+Molecular Weight: 191.249600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VUNXBQRNMNVUMV-UHFFFAOYSA-O

• 5-Hydroxymethyl-1h-Indazole
IUPAC Name: 1H-indazol-5-ylmethanol | CAS Registry Number: 478828-52-3
Synonyms: 1H-indazol-5-ylmethanol, AmbTiH30100, 5-Hydroxymethyl-1H-indazole, MolPort-000-003-980, ZINC01435963, CID1514190, H30100

Molecular Formula: C8H8N2OMolecular Weight: 148.161920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: UIXLZPHPSJUXBX-UHFFFAOYSA-N

• 1,2,3,4-Tetrahydroquinoline-6-Carboxylic Acid Methyl Ester
IUPAC Name: methyl 1,2,3,4-tetrahydroquinoline-6-carboxylate | CAS Registry Number: 177478-49-8
Synonyms: Methyl 1,2,3,4-Tetrahydroquinoline-6-carboxylate, 1,2,3,4-Tetrahydro-quinoline-6-carboxylic acid methyl ester, 1,2,3,4-Tetrahydroquinoline-6-carboxylic acid methyl ester, SureCN45146, AGN-PC-0156BG, AC1Q43O0, CTK4D6509, MolPort-002-506-788, ZINC12357136, AKOS005255822, AC-7425, AG-E-27742, GL-0842, MCULE-7889843786, AK-82582, AB1000711, KB-216245, EN300-67795, I14-17213, 6-Quinolinecarboxylic acid, 1,2,3,4-tetrahydro-, methyl ester

Molecular Formula: C11H13NO2Molecular Weight: 191.226420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PPSPOJUGGLXCIV-UHFFFAOYSA-N

• (R/S)-2-(3,4,5-Trimethoxyphenyl)butyric acid
IUPAC Name: (2R)-2-(3,4,5-trimethoxyphenyl)butanoate | CAS Registry Number: 195202-06-3
Synonyms: ZINC06667084, (2R)-2-(3,4,5-trimethoxyphenyl)butanoate, A813787

Molecular Formula: C13H17O5-Molecular Weight: 253.271080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: WBULUDGUWZFLMO-SECBINFHSA-M


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