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Obiter Research, LLC

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Contact: Chad Boulanger - President, CEO
Web: https://www.obires.com
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Address: 2809 Gemini Ct., Champaign, Illinois 61822-9647, USA
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Profile: Obiter Research, LLC specializes in offering fine chemicals, contract synthesis and custom manufacturing. We offer a wide range of fine & exotic chemicals including n-acetylindole, l-5-(3-amino-3-carboxypropylthio)pentanoic acid, 1-benzyl-1h-pyrrole-2,5-dione, 1,4-bis(2-chloroethoxy) benzene, methyl-piperdinyl-pyrazole dihydrochloride, (2s,3s)-2,3-bis(phenylcarbamoyloxy)succinic acid, 2-chloro-1-formyl-3-(hydroxymethylene)-1-cyclohexene, 2-chloro-4-methylpyrimidine, (n,n-dimethylaminopropyl) trimethoxysilane, 5-hydroxy-4-oxo-4h-pyran-2-carboxylic acid and n-isopropylmethylamine. We can accommodate projects that range from simple small molecules to the most challenging and complex compounds with quantities ranging from milligrams to kilograms. We are experienced at performing complex, multi-step synthesis and solving difficult chemistry problems. We can prepare compounds which incorporate deuterium, carbon-13, or nitrogen-15. We can intersect the synthetic schemes or can devise a new route based on the available labeled intermediates. All of our synthesis activities are complemented with analytical support to assure product identity & purity including in-process testing, reaction monitoring, and identification of impurities & byproducts.

1 to 50 of 51 Products/Chemicals (Click for related suppliers)  Page: [1] 2 >> Next 50 Results
• Benzoic acid, 2,4-dihydroxy-6-propyl-, methyl ester
IUPAC Name: methyl 2,4-dihydroxy-6-propylbenzoate | CAS Registry Number: 55382-52-0
Synonyms: CTK1F6891

Molecular Formula: C11H14O4Molecular Weight: 210.226460 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: AREDPURTHQTRTK-UHFFFAOYSA-N

• Hexaammineiridum (III) chloride (CAS: 14282-93-0)
• MENTHADIENOL
IUPAC Name: (1S,4R)-1-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol | CAS Registry Number: 22972-51-6
Synonyms: (1S,4R)-1-methyl-4-(prop-1-en-2-yl)cyclohex-2-enol, SBB055389, (1S,4R)-4-Isopropenyl-1-methylcyclohex-2-en-1-ol, 2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethenyl)-, (1S,4R)-, cis-Isolimonenol, UNII-1EOK52ZYQH, SureCN1114907, CYC048, p-Mentha-2,8-dien-1-beta-ol, CTK5J8229, (+)-p-Mentha-2,8-dien-1-ol, ANW-64774, FD7167, ZINC05158345, (+)-cis-p-Mentha-2,8-dien-1-ol, AKOS006288260, (1S,4R)-p-Menth-2,8-dien-1-ol, AG-B-73777, FEMA No. 4411, cis-(+)-, 2,8-P-Menthadien-1-ol, cis-(+)-

Molecular Formula: C10H16OMolecular Weight: 152.233440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MKPMHJQMNACGDI-VHSXEESVSA-N

• Methyl 2,4-dihydroxy-6-pentylbenzoate
IUPAC Name: methyl 2,4-dihydroxy-6-pentylbenzoate | CAS Registry Number: 58016-28-7
Synonyms: methyl olivetolate, BEN570, SCHEMBL2762730, ZINC34194051, 2,4-dihydroxy-6-pentyl-benzoic acid methyl ester, A1-00503, Benzoic acid, 2,4-dihydroxy-6-pentyl-, methyl ester

Molecular Formula: C13H18O4Molecular Weight: 238.279620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: RQGAOBDPFOADCM-UHFFFAOYSA-N

• N,N'-Bis[(11bR)-3,5-dihydro-3,5-dimethyl-4-oxido-4H-dinaphtho[2,1-d:1',2'-f][1,3,2]diazaphosphepin-4-yl]-N,N'-dimethyl-1,5-pentanediamine
Synonyms: AGN-PC-00A66U, (11bR,11b'R)-4,4'-(Pentane-1,5-diylbis(methylazanediyl))bis(3,5-dimethyl-4,5-dihydro-3H-dinaphtho[2,1-d:1',2'-f][1,3,2]diazaphosphepine 4-oxide), N,N inverted exclamation marka-Bis[(11bR)-3,5-dihydro-3,5-dimethyl-4-oxido-4H-dinaphtho[2,1-d:1 inverted exclamation marka,2 inverted exclamation marka-f][1,3,2]diazaphosphepin-4-yl]-N,N inverted exclamation marka-dimethyl-1,5-pentanediamine

Molecular Formula: C51H52N6O2P2Molecular Weight: 842.945104 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 8

InChIKey: HTIRTTKKZTYOST-UHFFFAOYSA-N

• N,N'-dimethyl-1,5-Pentanediamine, N,N'-bis[(11bS)-3,5-dihydro-3,5-dimethyl-4-oxido-4H-dinaphtho[2,1-d:1',2'-f][1,3,2]diazaphosphepin-4-yl] (CAS: 873306-78-6)
• N,N-bis(2-methylpropyl)-2-(octyl-phenylphosphoryl)acetamide
IUPAC Name: N,N-bis(2-methylpropyl)-2-[octyl(phenyl)phosphoryl]acetamide | CAS Registry Number: 83242-95-9
Synonyms: CID158335, Acetamide, N,N-bis(2-methylpropyl)-2-(octylphenylphosphinyl)-

Molecular Formula: C24H42NO2PMolecular Weight: 407.569541 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SGZRFMMIONYDQU-UHFFFAOYSA-N

• N,N-Diisopropylmethylamine
IUPAC Name: N-methyl-N-propan-2-ylpropan-2-amine | CAS Registry Number: 10342-97-9
Synonyms: Diisopropylmethylamine, N-Methyldiisopropylamine, 38431_ALDRICH, Diethylamine, N,1,1'-trimethyl-, 38431_FLUKA, N-Isopropyl-N-methyl-2-propanamine, CID547370, TL80090787, 2-Propanamine, N-methyl-N-(1-methylethyl)-

Molecular Formula: C7H17NMolecular Weight: 115.216580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ISRXMEYARGEVIU-UHFFFAOYSA-N

• N-Methylisopropylamine
IUPAC Name: N-methylpropan-2-amine | CAS Registry Number: 4747-21-1
Synonyms: Methylisopropylamine, Isopropylmethylamine, 2-Methylaminopropane, 2-Propanamine, N-methyl-, N-Isopropylmethylamine, Ethylamine, N,1-dimethyl-, N-methylpropan-2-amine, 359378_ALDRICH, 59595_FLUKA, NSC1065, 2-Propanamine, N-methyl- (9CI), CID78485, NSC 1065, EINECS 225-266-7, Ethylamine, N,1-dimethyl- (8CI), T5568710, InChI=1/C4H11N/c1-4(2)5-3/h4-5H,1-3H

Molecular Formula: C4H11NMolecular Weight: 73.136840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: XHFGWHUWQXTGAT-UHFFFAOYSA-N

• N-Methylpentane-2-amine
IUPAC Name: N-methylpentan-2-amine | CAS Registry Number: 22431-10-3
Synonyms: 1-Butanamine, 1,N-dimethyl, 2-N-Methylaminopentane, N-methylpentan-2-amine, AC1LB1NP, sec-Pentanamine, N-methyl-, N-METHYLPENTANE-2-AMINE, CTK3I5377, AKOS000163461, AG-F-76472, MCULE-2169396338, FT-0691521, I14-8412, 51932-19-5

Molecular Formula: C6H15NMolecular Weight: 101.190000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: IPBXLJFBVNLKFE-UHFFFAOYSA-N

• Olivetol
IUPAC Name: 5-pentylbenzene-1,3-diol | CAS Registry Number: 500-66-3
Synonyms: OLIVETOL, 5-Pentylresorcinol, 5-n-Amylresorcinol, 5-n-Pentylresorcinol, Resorcinol, 5-pentyl-, 3,5-Dihydroxyamylbenzene, Olivetol (6CI), 5-Pentyl-1,3-benzenediol, 1,3-Benzenediol, 5-pentyl-, CCRIS 6084, 3,5-Dihydroxypentylbenzene, 5-pentylbenzene-1,3-diol, 1,3-Dihydroxy-5-pentylbenzene, 152633_ALDRICH, Resorcinol, 5-pentyl- (8CI), EINECS 207-908-8, 1,3-Benzenediol, 5-pentyl- (9CI), CID10377, BRN 0908277, ZINC02040431

Molecular Formula: C11H16O2Molecular Weight: 180.243540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: IRMPFYJSHJGOPE-UHFFFAOYSA-N

• Pentanoic acid, 5-[(3-amino-3-carboxypropyl)thio]-
IUPAC Name: 5-(3-amino-3-carboxypropyl)sulfanylpentanoic acid | CAS Registry Number: 88096-02-0
Synonyms: AC1MRIJ4, CHEMBL211229, CTK3B8030, CHEBI:451515, 5-(3-amino-4-hydroxy-4-oxobutyl)sulfanylpentanoic acid

Molecular Formula: C9H17NO4SMolecular Weight: 235.300580 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: BMONDXDFXRPNKQ-UHFFFAOYSA-N

• Potassium Monopersulfate Sulfate (CAS: 70693-62-8)
• Tetrahydro-4-Methyl-2H-Pyran-2-One
IUPAC Name: 4-methyloxan-2-one | CAS Registry Number: 1121-84-2
Synonyms: 4-Methyltetrahydro-2H-pyran-2-one, NSC32358, CID79142, 2H-Pyran-2-one, tetrahydro-4-methyl-, EINECS 214-338-3, Tetrahydro-4-methyl-2H-pyran-2-one, S14-1465

Molecular Formula: C6H10O2Molecular Weight: 114.142400 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: YHTLGFCVBKENTE-UHFFFAOYSA-N

• Trimethylene Carbonate
IUPAC Name: 1,3-dioxan-2-one | CAS Registry Number: 2453-03-4
Synonyms: 1,3-Dioxan-2-one, 2-oxo-1,3-dioxane, Polytrimethylene carbonate, ACMC-1AFAK, [1,3]dioxan-2-one, AC1L3XDP, AC1Q6HSD, SureCN29060, SureCN3705478, KSC201E1R, 1,3-Dioxan-2-one, homopolymer, CTK1A1218, KST-1B3159, ANW-13737, AR-1B7087, ZINC02167011, AKOS006282041, AG-E-73232, KB-150244, D3821

Molecular Formula: C4H6O3Molecular Weight: 102.088640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YFHICDDUDORKJB-UHFFFAOYSA-N

• 4-chloro-2-fluorobenzoic acid
IUPAC Name: 4-chloro-2-fluorobenzoic acid | CAS Registry Number: 446-30-0
Synonyms: 4-Chloro-2-fluorobenzoic acid, 436763_ALDRICH, Benzoic acid, 4-chloro-2-fluoro-, 24622_FLUKA, NSC190363, CID99152, JRD-1483, EINECS 207-162-3, SBB003797, TL8003117, InChI=1/C7H4ClFO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11

Molecular Formula: C7H4ClFO2Molecular Weight: 174.556863 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ZLPXBWMVZANJJQ-UHFFFAOYSA-N

• 4-Bromoindole
IUPAC Name: 4-bromo-1H-indole | CAS Registry Number: 52488-36-5
Synonyms: 524336_ALDRICH, ZINC00039644, CID676494, B2073G1, ST5331239, TL8001555, B-8400, B-8404

Molecular Formula: C8H6BrNMolecular Weight: 196.043940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: GRJZJFUBQYULKL-UHFFFAOYSA-N

• 4-(2-Chloroethyl)-morpholine Hydrochloride
IUPAC Name: 4-(2-chloroethyl)morpholine hydrochloride | CAS Registry Number: 3647-69-6
Synonyms: Chloromorpholinoethane hydrochloride, C42203_ALDRICH, 2-Morpholinoethylchloride hydrochloride, N-(2-Chloroethyl)morpholine hydrochloride, (2-Chloroethyl)morpholine hydrochloride, 23051_FLUKA, 4-(2-Chloroethyl)morpholine hydrochloride, EINECS 222-881-2, NSC 10003, NSC 46824, WLN: T6N DOTJ A2G &GH, 4-(2-Chloroethyl)morpholinium chloride, NSC10003, NSC46824, Morpholine, (2-chloroethyl)-, hydrochloride, AI3-16221, Morpholine, 4-(2-chloroethyl)-, hydrochloride, 2-Morpholinoethyl chloride hydrochloride, N-(beta-Chloroethyl)morpholine-hydrochloride, LS-92595

Molecular Formula: C6H13Cl2NOMolecular Weight: 186.079520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NBJHDLKSWUDGJG-UHFFFAOYSA-N

• 4-Chloro-N'-hydroxybenzenecarboximidamide
IUPAC Name: 4-chloro-N'-hydroxybenzenecarboximidamide | CAS Registry Number: 5033-28-3
Synonyms: ZINC00127307, ST5410675

Molecular Formula: C7H7ClN2OMolecular Weight: 170.596280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: QBGONPQFBDUVPG-UHFFFAOYSA-N

• 1-Acetylindole
IUPAC Name: 1-indol-1-ylethanone | CAS Registry Number: 576-15-8
Synonyms: N-Acetylindole, Acetylindole, 1-Acetyl-1H-indole, Indole, 1-acetyl-, 1H-Indole, 1-acetyl-, ChemDiv2_000105, 377104_ALDRICH, EINECS 209-396-1, NSC521758, ZINC00149578, NSC 521758, ST5307708, EU-0000214, InChI=1/C10H9NO/c1-8(12)11-7-6-9-4-2-3-5-10(9)11/h2-7H,1H

Molecular Formula: C10H9NOMolecular Weight: 159.184560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: UUCUQJHYUPXDHN-UHFFFAOYSA-N

• 4-pyridinepropanol
IUPAC Name: 3-pyridin-4-ylpropan-1-ol | CAS Registry Number: 2629-72-3
Synonyms: 4-Pyridinepropanol, 4-(3-Hydroxypropyl)pyridine, 3-pyridin-4-ylpropan-1-ol, 3-(4-Pyridyl)-1-propanol, 3-(4-Pyridyl)propan-1-ol, 385646_ALDRICH, NSC3720, AIDS020384, AIDS-020384, NSC 3720, NSC66565, EINECS 220-107-8, NSC 66565, RTE2_000004, AI3-24361, InChI=1/C8H11NO/c10-7-1-2-8-3-5-9-6-4-8/h3-6,10H,1-2,7H

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

InChIKey: PZVZGDBCMQBRMA-UHFFFAOYSA-N

• 7-Bromoisoquinoline
IUPAC Name: 7-bromoisoquinoline | CAS Registry Number: 58794-09-5
Synonyms: 7-Bromo-isoquinoline, PubChem12736, SureCN692484, AC1Q251W, ISOQUINOLINE, 7-BROMO-, MolPort-004-968-808, ACT01973, ANW-75042, WTI-10018, ZINC14982275, AKOS005255699, AG-G-08354, PB34202, QC-9371, RP04660, RP26391, AK-26157, BR-26157, KB-46209, AB1007336

Molecular Formula: C9H6BrNMolecular Weight: 208.054640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: KABRXLINDSPGDF-UHFFFAOYSA-N

• 2-Hydroxy-4-methylpyrimidine hydrochloride
IUPAC Name: 6-methyl-1H-pyrimidin-2-one | CAS Registry Number: 5348-51-6
Synonyms: 6-Methyl-2-pyrimidone, 4-methyl-2-pyrimidinol, 2-Pyrimidinol, 4-methyl-, NSC1588, AIDS167229, 4-Methyl-2-oxo-(1H)-pyrimidine, AIDS-167229, EINECS 226-306-6, 4-Methylpyrimidin-2-ol hydrochloride, CID407091, SBB004337, ZINC01576897, AC-907/30003036

Molecular Formula: C5H6N2OMolecular Weight: 110.113940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: AHHHDTLXONDKQF-UHFFFAOYSA-N

• 6-Hydroxy-2,5,7,8-tetramethyl-chroman-2-carboxylic acid
IUPAC Name: 6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromene-2-carboxylic acid | CAS Registry Number: 53188-07-1
Synonyms: trolox, TROLOX C, Prestwick_855, Prestwick0_000530, Prestwick1_000530, Prestwick2_000530, Prestwick3_000530, Oprea1_727377, BSPBio_000519, MLS002153860, SPBio_002440, 238813_ALDRICH, BPBio1_000571, 56510_FLUKA, EINECS 258-422-8, AIDS114865, AIDS-114865, CID40634, BRN 5052542, SBB005933

Molecular Formula: C14H18O4Molecular Weight: 250.290320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GLEVLJDDWXEYCO-UHFFFAOYSA-N

• (R)-(-)-4-Penten-2-ol
IUPAC Name: (2R)-pent-4-en-2-ol | CAS Registry Number: 64584-92-5
Synonyms: (2R)-pent-4-en-2-ol, (2R)-4-penten-2-ol, AC1OE5KE, 4-Penten-2-ol, (2R)-, 558036_ALDRICH, CTK2F2717, ZINC02031653, AKOS005137973, AG-G-42416, AM804193, FT-0690332, A833828, A834817, I14-8367

Molecular Formula: C5H10OMolecular Weight: 86.132300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: ZHZCYWWNFQUZOR-RXMQYKEDSA-N

• 5-Hydroxy-4-oxo-4H-pyran-2-carboxylic acid
IUPAC Name: 5-hydroxy-4-oxopyran-2-carboxylic acid | CAS Registry Number: 499-78-5
Synonyms: Comenic acid, 2-Carboxy-5-hydroxy-4-pyrone, 681970_ALDRICH, CID68139, EINECS 207-891-7, 4H-Pyran-2-carboxylic acid, 5-hydroxy-4-oxo-, AO-801/41077391

Molecular Formula: C6H4O5Molecular Weight: 156.092960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: UUUICOMMFFTCHS-UHFFFAOYSA-N

• (1-mercaptoundec-11-yl) hexa (ethylene glycol)
IUPAC Name: 2-[2-[2-[2-[2-[2-(11-sulfanylundecoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol | CAS Registry Number: 130727-44-5
Synonyms: (1-Mercaptoundec-11-yl)hexa(ethylene glycol), Hexa(ethylene glycol)mono-11-mercaptoundecyl ether, 3,6,9,12,15,18-Hexaoxanonacosan-1-ol,29-mercapto-, MUHEG, ACMC-20mtrs, 675105_ALDRICH, CTK4B6895, AG-D-62376, (11-Mercaptoundecyl)hexa(ethylene glycol), (1-Mercapto-11-undecyl)hexa(ethyleneglycol); 11-[2-[2-[2-[2-[2-(2-Hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-1-undecanethiol

Molecular Formula: C23H48O7SMolecular Weight: 468.688020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: QYKSUHRPPSCIFK-UHFFFAOYSA-N

• 3-Maleimidopropionic acid N-hydroxysuccinimide ester
IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-(2,5-dioxopyrrol-1-yl)propanoate | CAS Registry Number: 55750-62-4
Synonyms: N-Succinimidyl 3-maleimidopropionate, 3-(Maleimido)propionic acid N-hydroxysuccinimide ester, BMPS, N-(3-Maleimidopropionyloxy)succinimide, 3-Maleimidopropionic Acid N-Succinimidyl Ester, N-Maleoyl-beta-alanine N-hydroxysuccinimide ester, N-Maleoyl-beta-alanine N'-hydroxysuccinimide ester, 3-maleimidopropionic acid n-hydroxy succinimide-ester, AC1NEOFI, PubChem19903, 358657_ALDRICH, 63179_FLUKA, 358657_SIGMA, MolPort-003-848-459, succinimido 3-maleimido-propionoate, (2,5-dioxopyrrolidin-1-yl) 3-(2,5-dioxopyrrol-1-yl)propanoate, 3-Maleimidopropionicacid-NHS(BMPS), 3-Maleimidopropionic acid-NHS(BMPS), AKOS005068164, RP29483

Molecular Formula: C11H10N2O6Molecular Weight: 266.206900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: JKHVDAUOODACDU-UHFFFAOYSA-N

• (N,N-Dimethylaminopropyl) trimethoxysilane
IUPAC Name: N,N-dimethyl-3-trimethoxysilylpropan-1-amine | CAS Registry Number: 2530-86-1
Synonyms: 539287_ALDRICH, EINECS 219-786-3, BB_SC-2613, CID75668, (N,N-Dimethylaminopropyl)trimethoxysilane, N,N-Dimethyl-3-(trimethoxysilyl)propylamine, 1-Propanamine, N,N-dimethyl-3-(trimethoxysilyl)-

Molecular Formula: C8H21NO3SiMolecular Weight: 207.342740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: QIOYHIUHPGORLS-UHFFFAOYSA-N

• (2R,3R)-2,3-bis(phenylcarbamoyloxy)succinic acid
IUPAC Name: (2R,3R)-2,3-bis(phenylcarbamoyloxy)butanedioic acid | CAS Registry Number: 145943-92-6
Synonyms: SureCN9398872, CTK4C4753, Butanedioic acid,2,3-bis[[(phenylamino)carbonyl]oxy]-, [R-(R*,R*)]- (9CI), AG-D-90091, (2R,3R)-2,3-bis(phenylcarbamoyloxy) succinic acid

Molecular Formula: C18H16N2O8Molecular Weight: 388.328240 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: KUQXJZZQKFACGT-ZIAGYGMSSA-N

• (2R)-3-Bromo-2-Hydroxy-2-Methylpropanoic Acid
IUPAC Name: (2R)-3-bromo-2-hydroxy-2-methylpropanoic acid | CAS Registry Number: 261904-39-6
Synonyms: (2R)-3-BROMO-2-HYDROXY-2-METHYLPROPANOIC ACID, AG-E-81808, CTK4F7330, MolPort-009-198-946, ACN-S001703, ACT07219, ANW-49726, AK-34422, BR-34422, KB-01262, FT-0604651, W4959, (R)-3-bromo-2-hydroxy-2-methylpropanoic acid, 91387-EP2284149A1, 91387-EP2305636A1, A818298, I04-1423, (2R)-3-bromanyl-2-methyl-2-oxidanyl-propanoic acid, Propanoic acid,3-bromo-2-hydroxy-2-methyl-, (2R)-, (+)-(2R)-3-Bromo-2-hydroxy-2-methylpropanoicacid;(2R)-3-Bromo-2-hydroxy-2-methylpropanoic acid;(2R)-3-Bromo-2-hydroxy-2-methylpropionicacid;

Molecular Formula: C4H7BrO3Molecular Weight: 183.000580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: HBJAYXGUOOININ-BYPYZUCNSA-N

• 9-(Trifluoroacetyl) anthracene
IUPAC Name: 1-anthracen-9-yl-2,2,2-trifluoroethanone | CAS Registry Number: 53531-31-0
Synonyms: 9-Anthryl trifluoromethyl ketone, 218014_ALDRICH, ZINC02140839, RJC01046, EINECS 258-609-4, CID104525, 1-anthracen-9-yl-2,2,2-trifluoroethanone, Ethanone, 1-(9-anthracenyl)-2,2,2-trifluoro-

Molecular Formula: C16H9F3OMolecular Weight: 274.237270 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: MNCMBBIFTVWHIP-UHFFFAOYSA-N

• 2-phenyl-3-(4-hydroxyphenyl)-5,7-bis(trifluoromethyl)-pyrazolo[1,5-alpha] pyrimidine (CAS: 805239-55-8)
• 2-Iodobenzoic Acid
IUPAC Name: 2-iodobenzoic acid | CAS Registry Number: 88-67-5
Synonyms: o-Iodobenzoic acid, 2-IODOBENZOIC ACID, Progonasyl, Benzoic acid, 2-iodo-, Benzoic acid, o-iodo-, Iodobenzoic acid, OISB, Benzoic acid, iodo-, sodium 2-iodobenzoate, USAF EK-572, Maybridge1_001326, WLN: QVR BI, ortho-iodo-sodium benzoate, I7675_ALDRICH, Kyselina o-jodbenzoova [Czech], C7H5IO2, o-iodobenzoic-(125)I acid, 2-iodobenzoic-(125)I acid, 418463_ALDRICH, 2-(Iodo-(125)I)-benzoic acid

Molecular Formula: C7H5IO2Molecular Weight: 248.017870 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CJNZAXGUTKBIHP-UHFFFAOYSA-N

• 2-[2-Methyl-4-[[[4-methyl-2-[4-(trifluor
IUPAC Name: 2-[2-methyl-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]phenoxy]acetic acid | CAS Registry Number: 317318-70-0
Synonyms: GSK-516, GW-516, PDSP1_000255, PDSP2_000254, GW501516, GW-501516, LS-193006, {2-methyl-4-[({4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}methyl)sulfanyl]phenoxy}acetic acid, Acetic acid, (2-methyl-4-(((4-methyl-2-(4-(trifluoromethyl)phenyl)-5-thiazolyl)methyl)thio)phenoxy)-

Molecular Formula: C21H18F3NO3S2Molecular Weight: 453.497730 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: YDBLKRPLXZNVNB-UHFFFAOYSA-N

• 1-Bromo-2,6-diisopropylbenzene
IUPAC Name: 2-bromo-1,3-di(propan-2-yl)benzene | CAS Registry Number: 57190-17-7
Synonyms: 2,6-Diisopropylbromobenzene, SureCN2202295, 2,6-Diisopropylphenyl bromide, 2-Bromo-1,3-diisopropylbenzene, CTK1F2717, 2-Bromo-1,3-bis(1-methylethyl)benzene, Benzene, 2-bromo-1,3-bis(1-methylethyl)-

Molecular Formula: C12H17BrMolecular Weight: 241.167380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: QEOQKWIURDCGIJ-UHFFFAOYSA-N

• 2(3H)-Furanone, dihydro-3-(2-propenyl)-
IUPAC Name: 3-prop-2-enyloxolan-2-one | CAS Registry Number: 10491-63-1
Synonyms: SureCN576860, 3-allyl-tetrahydro-furan-2-one, 3-allyldihydro-2(3H)-furanone, CTK0G5908, AKOS015905264

Molecular Formula: C7H10O2Molecular Weight: 126.153100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: USLBMAZTSPYPLP-UHFFFAOYSA-N

• 1,3-Dioxan-2-one, 5-(phenylmethoxy)-
IUPAC Name: 5-phenylmethoxy-1,3-dioxan-2-one | CAS Registry Number: 86629-66-5
Synonyms: SureCN1492510, CTK3C6848

Molecular Formula: C11H12O4Molecular Weight: 208.210580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: RTJMBRNDSHKMEX-UHFFFAOYSA-N

• (R)-2,2?DIAMINO-6,6?DIMETHYLBIPHENYL,(R)-6,6?DIMETHYL-2,2?DIAMINOBIPHENYL,(R)-6,6?DIMETHYL-1,1?BIPHENYL-2,2?DIAMINE,(R)-6,6?DIMETHYL-1,1?BIPHENYL-2,2?DIYLDIAMINE
IUPAC Name: 2-(2-amino-6-methylphenyl)-3-methylaniline | CAS Registry Number: 3685-06-1
Synonyms: 2-(2-amino-6-methylphenyl)-3-methylaniline, ST50036770, 20261-65-8, ZINC00453215, AC1LH5VW, SureCN3462069, Oprea1_421415, Oprea1_742699, MLS000684026, CTK8F2009, MolPort-000-422-013, HMS1587I15, HMS2740P14, STK964132, 6,6'-dimethylbiphenyl-2,2'-diamine, 2,2'-Diamino-6,6'-dimethylbiphenyl, AKOS002161918, AG-F-28819, 2,2'-Diamino-6,6'-dimethyl-biphenyl, AK-79898

Molecular Formula: C14H16N2Molecular Weight: 212.290240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: MCUUKQCKNKUMBP-UHFFFAOYSA-N

• 1,4-BIS(2-CHLOROETHOXY)BENZENE
IUPAC Name: 1,4-bis(2-chloroethoxy)benzene | CAS Registry Number: 37142-37-3
Synonyms: 1,4-bis(2-chloroethoxy)benzene, bischloroethoxybenzene, AC1N7WV9, SureCN5636691, CTK4H7804, MolPort-001-493-062, SBB098369, AKOS005070642, AG-F-30042, RP13494, FT-0663243, 2-chloro-1-[4-(2-chloroethoxy)phenoxy]ethane, 4Y-0018, I01-14429

Molecular Formula: C10H12Cl2O2Molecular Weight: 235.107080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DKPKDJGAQOVXJC-UHFFFAOYSA-N

• 3-(1-Naphthoyl)indole
IUPAC Name: 1H-indol-3-yl(naphthalen-1-yl)methanone | CAS Registry Number: 109555-87-5
Synonyms: Methanone,1H-indol-3-yl-1-naphthalenyl-, 1H-INDOL-3-YL-1-NAPHTHALENYLMETHANONE, ACMC-209xls, SureCN8530849, Indol-3-yl 1-Naphthyl Ketone, CTK4A6580, MolPort-008-689-988, ACT06985, ANW-47822, AKOS005146536, AG-I-03032, 1H-Indol-3-yl-1-naphthalenyl-methanone, AK-28373, BR-28373, KB-218951, X8924, I14-32295, Ketone,indol-3-yl 1-naphthyl (6CI);3-(1-Naphthoyl)indole;

Molecular Formula: C19H13NOMolecular Weight: 271.312620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: QIXQGVQLBPQVOR-UHFFFAOYSA-N

• (S)-(-)-6,6-DIMETHYL-2,2-BIPHENYLDIAM
IUPAC Name: 2-(2-amino-6-methylphenyl)-3-methylaniline | CAS Registry Number: 3685-05-0
Synonyms: 2-(2-amino-6-methylphenyl)-3-methylaniline, ST50036770, 20261-65-8, 3685-06-1, ZINC00453215, AC1LH5VW, SureCN3462069, Oprea1_421415, Oprea1_742699, MLS000684026, CTK8F2009, MolPort-000-422-013, HMS1587I15, HMS2740P14, STK964132, 6,6'-dimethylbiphenyl-2,2'-diamine, 2,2'-Diamino-6,6'-dimethylbiphenyl, AKOS002161918, AG-F-28819, 2,2'-Diamino-6,6'-dimethyl-biphenyl

Molecular Formula: C14H16N2Molecular Weight: 212.290240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: MCUUKQCKNKUMBP-UHFFFAOYSA-N

• 1,,3,5-Triaminobenzene trihydrochloride
IUPAC Name: benzene-1,3,5-triamine;trihydrochloride | CAS Registry Number: 638-09-5
Synonyms: Benzene-1,3,5-triamine trihydrochloride, 1,3,5-Triaminobenzene trihydrochloride, SureCN2351290, CTK7D5881, ANW-60909, AKOS007930156, AG-C-19667, BENZENE-1,3,5-TRIAMINE 3HCL, AK-78924, KB-250687, FT-0083621

Molecular Formula: C6H12Cl3N3Molecular Weight: 232.538580 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 3

InChIKey: GSPBVFMIOSWQJB-UHFFFAOYSA-N

• 18-Methoxycoronaridine
Synonyms: 18-methoxycoronaridine, CHEBI:249093

Molecular Formula: C22H28N2O3Molecular Weight: 368.469320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: DTJQBBHYRQYDEG-YHIIEBRDSA-N

• 2-Propen-1-amine, N-(1,1-dimethylethyl)-
IUPAC Name: 2-methyl-N-prop-2-enylpropan-2-amine | CAS Registry Number: 16486-68-3
Synonyms: N-(tert-Butyl)-2-propen-1-amine, N-tert-Butylallylamine, AC1LBYLY, N-Allyl-N-tert-butylamine, CTK0E5844, N-Tert.-butyl-N-(2-propenyl)amine, AKOS009132223, 2-methyl-N-prop-2-enylpropan-2-amine

Molecular Formula: C7H15NMolecular Weight: 113.200700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MDFOQCKFSUMLET-UHFFFAOYSA-N

• (1R,4S)-1-Methyl-4-(prop-1-en-2-yl)cyclohex-2-enol
IUPAC Name: (1R,4S)-1-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol | CAS Registry Number: 82769-01-5
Synonyms: AC1NSXYS, CHEMBL504494, AK140835, 1-Methyl-4-(1-methylethenyl)-2-cyclohexen-1-ol cis-, (1R,4S)-1-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol, 2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethenyl)-, cis-, 3886-78-0

Molecular Formula: C10H16OMolecular Weight: 152.233440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MKPMHJQMNACGDI-ZJUUUORDSA-N

• 2,3,3-Trimethyl-3H-Indole-5-Sulfonic Acid
IUPAC Name: 2,3,3-trimethylindole-5-sulfonic acid | CAS Registry Number: 132557-72-3
Synonyms: 2,3,3-trimethyl-3H-indole-5-sulfonic acid, 132557-73-4, 3H-Indole-5-sulfonicacid, 2,3,3-trimethyl-, PubChem7510, 2,3,3-trimethylindole-5-sulfonic Acid, ACMC-20a65l, Jsp001972, CTK0H4632, MolPort-003-984-702, ANW-58903, AKOS015889770, AG-D-66167, 2,3,3-trimethyl-5-indolesulfonic acid, 2,3,3-Trimethylindole-5-sulfonic acid;, AK-57881, P306, KB-224906, FT-0652577, ST51051747, A806458

Molecular Formula: C11H13NO3SMolecular Weight: 239.290820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HUFDYAIAEFHOKI-UHFFFAOYSA-N

• 2-[TRIS(HYDROXYMETHYL)-METHYLAMINO]-ETHANOL
IUPAC Name: 2-(2-hydroxyethylamino)-2-(hydroxymethyl)propane-1,3-diol | CAS Registry Number: 7343-51-3
Synonyms: EINECS 230-862-5, MolPort-004-963-626, CID81798, ST5824875, 2-((2-Hydroxyethyl)amino)-2-(hydroxymethyl)propane-1,3-diol, 1,3-Propanediol, 2-((2-hydroxyethyl)amino)-2-(hydroxymethyl)-

Molecular Formula: C6H15NO4Molecular Weight: 165.187600 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 5

InChIKey: OTWJRAWXTDGSDT-UHFFFAOYSA-N

• (2R,2'S)-2,2'-bipyrrolidine
IUPAC Name: 2-pyrrolidin-2-ylpyrrolidine | CAS Registry Number: 107886-07-7
Synonyms: 2,2'-Bipyrrolidine, 74295-58-2, 2,2'-Bipyrrolidine, (2S,2'S)-, 124779-66-4, [2,2']bipyrrolidinyl, ACMC-20mr6v, cis-2,2'-Bipyrrolidine, trans-2,2'-Bipyrrolidine, SCHEMBL661111, CTK2G1474, NQHVTVSAFRAXPA-UHFFFAOYSA-N, 107886-22-6, 137037-20-8, AKOS006354191, (2R,2'R)-(-)-2,2'-Bipyrrolidine, (2S,2'S)-(+)-2,2'-Bipyrrolidine

Molecular Formula: C8H16N2Molecular Weight: 140.230 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: NQHVTVSAFRAXPA-UHFFFAOYSA-N

• (-)-18-Methoxycoronaridine hydrochloride
IUPAC Name: methyl (1~{S},15~{R},17~{R},18~{S})-17-(2-methoxyethyl)-3,13-diazapentacyclo[13.3.1.0^{2,10}.0^{4,9}.0^{13,18}]nonadeca-2(10),4,6,8-tetraene-1-carboxylate;hydrochloride | CAS Registry Number: 1388145-90-1
Synonyms: UNII-85Z0P8329N, 85Z0P8329N, 18-Methoxycoronaridine hydrochloride, (+/-)-, Ibogamine-18-carboxylic acid, 21-methoxy-, methyl ester, hydrochloride (1:1), Ibogamine-18-carboxylic acid, 21-methoxy-, methyl ester, monohydrochloride, 266686-77-5, 6,9-Methano-5H-pyrido(1',2':1,2)azepino(4,5-b)indole-6(6ah)-carboxylic acid, 7,8,9,10,12,13-hexahydro-7-(2-methoxyethyl)-, methyl ester, hydrochloride (1:1), (6R,6aR,7S,9S,11R)-rel-, UNII-LN5K0F4GJF component CVBFKKVQGICEBT-BWXWGAIDSA-N

Molecular Formula: C22H29ClN2O3Molecular Weight: 404.935 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: CVBFKKVQGICEBT-BWXWGAIDSA-N


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