Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.

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2,146 – 2,160 of 208,279 results

2,146

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N,N-Diethylpropargylamine, 97%

CAS: 4079-68-9 Molecular Formula: C₇H₁₃N Molecular Weight (g/mol): 111.18 InChI Key: JZJXKEWVUBVOEH-UHFFFAOYSA-N PubChem CID: 20010

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Specifications

PubChem CID	20010
CAS	4079-68-9
Molecular Weight (g/mol)	111.18
InChI Key	JZJXKEWVUBVOEH-UHFFFAOYSA-N
Molecular Formula	C₇H₁₃N

2,147

Pancuronium bromide, MP Biomedicals™

CAS: 15500-66-0 Molecular Formula: C35H62Br2N2O4+2 Molecular Weight (g/mol): 734.699 MDL Number: MFCD00079223 InChI Key: NPIJXCQZLFKBMV-YTGGZNJNSA-N Synonym: 1,1'-[2β,3α,5α,16b,17b-3-17-bis(acetyloxy)-androstane-2,16-diyl]bis[1-methylpiperidinium]dibromide PubChem CID: 129893486 IUPAC Name: [(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-acetyloxy-10,13-dimethyl-2,16-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate;dihydrobromide SMILES: CC(=O)OC1CC2CCC3C(C2(CC1[N+]4(CCCCC4)C)C)CCC5(C3CC(C5OC(=O)C)[N+]6(CCCCC6)C)C.Br.Br

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Specifications

PubChem CID	129893486
CAS	15500-66-0
Molecular Weight (g/mol)	734.699
MDL Number	MFCD00079223
SMILES	CC(=O)OC1CC2CCC3C(C2(CC1[N+]4(CCCCC4)C)C)CCC5(C3CC(C5OC(=O)C)[N+]6(CCCCC6)C)C.Br.Br
Synonym	1,1'-[2β,3α,5α,16b,17b-3-17-bis(acetyloxy)-androstane-2,16-diyl]bis[1-methylpiperidinium]dibromide
IUPAC Name	[(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-acetyloxy-10,13-dimethyl-2,16-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate;dihydrobromide
InChI Key	NPIJXCQZLFKBMV-YTGGZNJNSA-N
Molecular Formula	C35H62Br2N2O4+2

2,148

1-(tert-Butyl) 2-methyl 1,2-indolinedicarboxylate, 97%, Thermo Scientific™

CAS: 186704-03-0 Molecular Formula: C15H19NO4 Molecular Weight (g/mol): 277.32 MDL Number: MFCD06200867 InChI Key: JWTYDRKOSWALHD-UHFFFAOYSA-N Synonym: 1-tert-butyl 2-methyl 1,2-indolinedicarboxylate,1-tert-butyl 2-methyl indoline-1,2-dicarboxylate,1-tert-butyl-2-methylindoline-1,2-dicarboxylate,1-tert-butyl 2-methyl 2,3-dihydroindole-1,2-dicarboxylate,1-boc-indolin-2-carboxylic acid methyl ester,1-tert-butyl-2-methyl-1,2-indoline dicarboxylate,1-tert-butoxycarbonyl indoline-2-carboxylic acid methyl ester PubChem CID: 2794661 IUPAC Name: 1-O-tert-butyl 2-O-methyl 2,3-dihydroindole-1,2-dicarboxylate SMILES: CC(C)(C)OC(=O)N1C(CC2=CC=CC=C21)C(=O)OC

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Specifications

PubChem CID	2794661
CAS	186704-03-0
Molecular Weight (g/mol)	277.32
MDL Number	MFCD06200867
SMILES	CC(C)(C)OC(=O)N1C(CC2=CC=CC=C21)C(=O)OC
Synonym	1-tert-butyl 2-methyl 1,2-indolinedicarboxylate,1-tert-butyl 2-methyl indoline-1,2-dicarboxylate,1-tert-butyl-2-methylindoline-1,2-dicarboxylate,1-tert-butyl 2-methyl 2,3-dihydroindole-1,2-dicarboxylate,1-boc-indolin-2-carboxylic acid methyl ester,1-tert-butyl-2-methyl-1,2-indoline dicarboxylate,1-tert-butoxycarbonyl indoline-2-carboxylic acid methyl ester
IUPAC Name	1-O-tert-butyl 2-O-methyl 2,3-dihydroindole-1,2-dicarboxylate
InChI Key	JWTYDRKOSWALHD-UHFFFAOYSA-N
Molecular Formula	C15H19NO4

2,149

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4-Nitrophenyl-beta-D-galactopyranoside hydrate, 98+%

CAS: 200422-18-0 Molecular Formula: C12H15NO8 Molecular Weight (g/mol): 301.25 MDL Number: MFCD00063256 InChI Key: IFBHRQDFSNCLOZ-MFZRPPIDNA-N Synonym: 4-nitrophenyl-beta-d-galactopyranoside hydrate,2r,3r,4s,5r,6s-2-hydroxymethyl-6-4-nitrophenoxy tetrahydro-2h-pyran-3,4,5-triol hydrate,p-nitrophenyl-?-d-galactoside hydrate,4-nitrophenyl beta-d-galactopyranoside hydrate PubChem CID: 16218614 IUPAC Name: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxane-3,4,5-triol;hydrate SMILES: OC[C@H]1O[C@@H](OC2=CC=C(C=C2)[N+]([O-])=O)[C@H](O)[C@@H](O)[C@H]1O

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Specifications

PubChem CID	16218614
CAS	200422-18-0
Molecular Weight (g/mol)	301.25
MDL Number	MFCD00063256
SMILES	OC[C@H]1O[C@@H](OC2=CC=C(C=C2)[N+]([O-])=O)[C@H](O)[C@@H](O)[C@H]1O
Synonym	4-nitrophenyl-beta-d-galactopyranoside hydrate,2r,3r,4s,5r,6s-2-hydroxymethyl-6-4-nitrophenoxy tetrahydro-2h-pyran-3,4,5-triol hydrate,p-nitrophenyl-?-d-galactoside hydrate,4-nitrophenyl beta-d-galactopyranoside hydrate
IUPAC Name	(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxane-3,4,5-triol;hydrate
InChI Key	IFBHRQDFSNCLOZ-MFZRPPIDNA-N
Molecular Formula	C12H15NO8

2,150

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Glassy carbon spherical powder, 0.4-12 micron, type 2

MDL Number: MFCD00133992

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Specifications

MDL Number	MFCD00133992

2,151

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(±)-Ibotenic acid monohydrate, 95%, Thermo Scientific Chemicals

CAS: 60573-88-8 Molecular Formula: C₅H₆N₂O₄·H₂O Molecular Weight (g/mol): 176.1 MDL Number: MFCD00149579 InChI Key: QVKQQLYSTODTJN-UHFFFAOYSA-N Synonym: ibotenic acid hydrate,ibotenic acid monohydrate,pramuscimol,ibotensaeure,isotenic acid,ibotensaeure german,amino-3-hydroxy-5-isoxazolyl acetic acid,alpha-amino-3-hydroxy-5-isoxazolessigsaure hydrat,alpha-amino-3-hydroxy-5-isoxazoleacetic acid hydrate,alpha-amino-3-hydroxy-5-isoxazolessigsaure hydrat german PubChem CID: 43362 IUPAC Name: 2-amino-2-(3-oxo-1,2-oxazol-5-yl)acetic acid;hydrate SMILES: C1=C(ONC1=O)C(C(=O)O)N.O

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Specifications

PubChem CID	43362
CAS	60573-88-8
Molecular Weight (g/mol)	176.1
MDL Number	MFCD00149579
SMILES	C1=C(ONC1=O)C(C(=O)O)N.O
Synonym	ibotenic acid hydrate,ibotenic acid monohydrate,pramuscimol,ibotensaeure,isotenic acid,ibotensaeure german,amino-3-hydroxy-5-isoxazolyl acetic acid,alpha-amino-3-hydroxy-5-isoxazolessigsaure hydrat,alpha-amino-3-hydroxy-5-isoxazoleacetic acid hydrate,alpha-amino-3-hydroxy-5-isoxazolessigsaure hydrat german
IUPAC Name	2-amino-2-(3-oxo-1,2-oxazol-5-yl)acetic acid;hydrate
InChI Key	QVKQQLYSTODTJN-UHFFFAOYSA-N
Molecular Formula	C₅H₆N₂O₄·H₂O

2,152

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Thermo Scientific Chemicals Pravastatin sodium salt hydrate

CAS: 2244386-63-6 Molecular Formula: C23H35NaO7 Molecular Weight (g/mol): 446.52 MDL Number: MFCD00887601 InChI Key: VWBQYTRBTXKKOG-IYNICTALSA-M IUPAC Name: sodium (3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-{[(2S)-2-methylbutanoyl]oxy}-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate SMILES: [Na+].[H][C@]12[C@H](C[C@H](O)C=C1C=C[C@H](C)[C@@H]2CC[C@@H](O)C[C@@H](O)CC([O-])=O)OC(=O)[C@@H](C)CC

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Specifications

CAS	2244386-63-6
Molecular Weight (g/mol)	446.52
MDL Number	MFCD00887601
SMILES	[Na+].[H][C@]12[C@H](C[C@H](O)C=C1C=C[C@H](C)[C@@H]2CC[C@@H](O)C[C@@H](O)CC([O-])=O)OC(=O)[C@@H](C)CC
IUPAC Name	sodium (3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-{[(2S)-2-methylbutanoyl]oxy}-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate
InChI Key	VWBQYTRBTXKKOG-IYNICTALSA-M
Molecular Formula	C23H35NaO7

2,153

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2-Methylindoline, 99+%

CAS: 6-6-6872 Molecular Formula: C₉H₁₁N Molecular Weight (g/mol): 133.19 MDL Number: MFCD00005706 InChI Key: QRWRJDVVXAXGBT-UHFFFAOYNA-N Synonym: 2-methylindoline,2-methyl-2,3-dihydro-1h-indole,2,3-dihydro-2-methylindole,1h-indole, 2,3-dihydro-2-methyl,indoline, 2-methyl,2-methyl-2,3-dihydroindole,dihydroindole, 2-methyl,alpha-methyldihydroindole,.alpha.-methyldihydroindole,2,3-dihydro-2-methyl-1h-indole PubChem CID: 23305

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Specifications

PubChem CID	23305
CAS	6-6-6872
Molecular Weight (g/mol)	133.19
MDL Number	MFCD00005706
Synonym	2-methylindoline,2-methyl-2,3-dihydro-1h-indole,2,3-dihydro-2-methylindole,1h-indole, 2,3-dihydro-2-methyl,indoline, 2-methyl,2-methyl-2,3-dihydroindole,dihydroindole, 2-methyl,alpha-methyldihydroindole,.alpha.-methyldihydroindole,2,3-dihydro-2-methyl-1h-indole
InChI Key	QRWRJDVVXAXGBT-UHFFFAOYNA-N
Molecular Formula	C₉H₁₁N

2,154

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Thymoquinone, 99%

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2,155

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DL-2,3-Diaminopropionic acid monohydrochloride, 99%

CAS: 54897-59-5 Molecular Formula: C₃H₈N₂O₂·HCl Molecular Weight (g/mol): 140.57 MDL Number: MFCD00012884 InChI Key: SKWCZPYWFRTSDD-UHFFFAOYSA-N Synonym: 2,3-diaminopropanoic acid hydrochloride,dl-2,3-diaminopropionic acid hydrochloride,3-amino-dl-alanine hydrochloride,dl-2,3-diaminopropionic acid monohydrochloride,2,3-diaminopropionic acid hydrochloride,+--2,3-diaminopropionic acid hydrochloride,3-amino-dl-alanine monohydrochloride,2,3-diaminopropionic acid monohydrochloride,dl-2,3-diaminopropanoic acid hydrochloride,diaminopropionic acid PubChem CID: 108638 IUPAC Name: 2,3-diaminopropanoic acid;hydrochloride SMILES: C(C(C(=O)O)N)N.Cl

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Specifications

PubChem CID	108638
CAS	54897-59-5
Molecular Weight (g/mol)	140.57
MDL Number	MFCD00012884
SMILES	C(C(C(=O)O)N)N.Cl
Synonym	2,3-diaminopropanoic acid hydrochloride,dl-2,3-diaminopropionic acid hydrochloride,3-amino-dl-alanine hydrochloride,dl-2,3-diaminopropionic acid monohydrochloride,2,3-diaminopropionic acid hydrochloride,+--2,3-diaminopropionic acid hydrochloride,3-amino-dl-alanine monohydrochloride,2,3-diaminopropionic acid monohydrochloride,dl-2,3-diaminopropanoic acid hydrochloride,diaminopropionic acid
IUPAC Name	2,3-diaminopropanoic acid;hydrochloride
InChI Key	SKWCZPYWFRTSDD-UHFFFAOYSA-N
Molecular Formula	C₃H₈N₂O₂·HCl

2,156

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4,4-Dimethylcyclohexanone, 97%

CAS: 4255-62-3 InChI Key: PXQMSTLNSHMSJB-UHFFFAOYSA-N Synonym: 4,4-dimethylcyclohexanone,cyclohexanone, 4,4-dimethyl,4,4-dimethyl cyclohexanone,4,4-dimethyl-cyclohexan-1-one,4,4-dimethycyclohexanone,4.4-dimethylcyclohexanone,acmc-209jq8,4,4-dimethyl-cyclohexanone,ksc494a0f,4,4-dimethyl-1-cyclohexanone PubChem CID: 138166 IUPAC Name: 4,4-dimethylcyclohexan-1-one SMILES: CC1(CCC(=O)CC1)C

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Specifications

PubChem CID	138166
CAS	4255-62-3
SMILES	CC1(CCC(=O)CC1)C
Synonym	4,4-dimethylcyclohexanone,cyclohexanone, 4,4-dimethyl,4,4-dimethyl cyclohexanone,4,4-dimethyl-cyclohexan-1-one,4,4-dimethycyclohexanone,4.4-dimethylcyclohexanone,acmc-209jq8,4,4-dimethyl-cyclohexanone,ksc494a0f,4,4-dimethyl-1-cyclohexanone
IUPAC Name	4,4-dimethylcyclohexan-1-one
InChI Key	PXQMSTLNSHMSJB-UHFFFAOYSA-N

2,157

Ethyl isocyanatoacetate, 98%

CAS: 2949-22-6 Molecular Formula: C5H7NO3 Molecular Weight (g/mol): 129.12 MDL Number: MFCD00002040 InChI Key: DUVOZUPPHBRJJO-UHFFFAOYSA-N Synonym: ethyl isocyanatoacetate,isocyanatoacetic acid ethyl ester,acetic acid, isocyanato-, ethyl ester,carbethoxymethyl isocyanate,isocyanatoethyl acetate,ethoxycarbonylmethyl isocyanate,ethylisocyanatoacetate,ethyl glycolate isocyanate,ethyl n-oxomethylene glycinate,acetic acid,2-isocyanato-, ethyl ester PubChem CID: 76283 IUPAC Name: ethyl 2-isocyanatoacetate SMILES: CCOC(=O)CN=C=O

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Specifications

PubChem CID	76283
CAS	2949-22-6
Molecular Weight (g/mol)	129.12
MDL Number	MFCD00002040
SMILES	CCOC(=O)CN=C=O
Synonym	ethyl isocyanatoacetate,isocyanatoacetic acid ethyl ester,acetic acid, isocyanato-, ethyl ester,carbethoxymethyl isocyanate,isocyanatoethyl acetate,ethoxycarbonylmethyl isocyanate,ethylisocyanatoacetate,ethyl glycolate isocyanate,ethyl n-oxomethylene glycinate,acetic acid,2-isocyanato-, ethyl ester
IUPAC Name	ethyl 2-isocyanatoacetate
InChI Key	DUVOZUPPHBRJJO-UHFFFAOYSA-N
Molecular Formula	C5H7NO3

2,158

(5RS)-3-(2-Hydroxyphenyl)-5-phenylcyclohex-2-enone, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.