Indoles and derivatives

Aromatic bicyclic organic compounds that consists of a benzene ring fused to a pyrrole ring with formula: C₈H₇N.

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Carbazole, 95%

CAS: 86-74-8 Molecular Formula: C12H9N Molecular Weight (g/mol): 167.21 MDL Number: MFCD00004960 InChI Key: UJOBWOGCFQCDNV-UHFFFAOYSA-N Synonym: carbazole,dibenzopyrrole,diphenylenimine,9-azafluorene,diphenylenimide,diphenyleneimine,dibenzo b,d pyrrole,usaf ek-600,unii-0p2197hhhn PubChem CID: 6854 ChEBI: CHEBI:27543 IUPAC Name: 9H-carbazole SMILES: N1C2=C(C=CC=C2)C2=C1C=CC=C2

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PubChem CID	6854
CAS	86-74-8
Molecular Weight (g/mol)	167.21
ChEBI	CHEBI:27543
MDL Number	MFCD00004960
SMILES	N1C2=C(C=CC=C2)C2=C1C=CC=C2
Synonym	carbazole,dibenzopyrrole,diphenylenimine,9-azafluorene,diphenylenimide,diphenyleneimine,dibenzo b,d pyrrole,usaf ek-600,unii-0p2197hhhn
IUPAC Name	9H-carbazole
InChI Key	UJOBWOGCFQCDNV-UHFFFAOYSA-N
Molecular Formula	C12H9N

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7-Hydroxyindole, 95%

CAS: 2380-84-9 Molecular Formula: C₈H₇NO Molecular Weight (g/mol): 133.15 InChI Key: ORVPXPKEZLTMNW-UHFFFAOYSA-N Synonym: 7-hydroxyindole,7-indolol,7-hydroxy-1h-indole,indol-7-ol,7-hydroxy-indole,pubchem7345,7-hydroxylindole PubChem CID: 2737651 IUPAC Name: 1H-indol-7-ol SMILES: C1=CC2=C(C(=C1)O)NC=C2

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PubChem CID	2737651
CAS	2380-84-9
Molecular Weight (g/mol)	133.15
SMILES	C1=CC2=C(C(=C1)O)NC=C2
Synonym	7-hydroxyindole,7-indolol,7-hydroxy-1h-indole,indol-7-ol,7-hydroxy-indole,pubchem7345,7-hydroxylindole
IUPAC Name	1H-indol-7-ol
InChI Key	ORVPXPKEZLTMNW-UHFFFAOYSA-N
Molecular Formula	C₈H₇NO

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Thermo Scientific Chemicals Indomethacin

CAS: 53-86-1 Molecular Formula: C₁₉H₁₆ClNO₄ Molecular Weight (g/mol): 357.79 InChI Key: CGIGDMFJXJATDK-UHFFFAOYSA-N Synonym: indomethacin,indometacin,indocin,indometacine,indomethacine,indocid,metindol,amuno,indomethazine,imbrilon PubChem CID: 3715 ChEBI: CHEBI:49662 IUPAC Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid SMILES: CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)O

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PubChem CID	3715
CAS	53-86-1
Molecular Weight (g/mol)	357.79
ChEBI	CHEBI:49662
SMILES	CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)O
Synonym	indomethacin,indometacin,indocin,indometacine,indomethacine,indocid,metindol,amuno,indomethazine,imbrilon
IUPAC Name	2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid
InChI Key	CGIGDMFJXJATDK-UHFFFAOYSA-N
Molecular Formula	C₁₉H₁₆ClNO₄

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5-Bromoindole-3-acetic acid, 97%, Thermo Scientific Chemicals

CAS: 40432-84-6 Molecular Formula: C10H8BrNO2 Molecular Weight (g/mol): 254.083 MDL Number: MFCD00005637 InChI Key: WTFGHMZUJMRWBK-UHFFFAOYSA-N Synonym: 5-bromoindole-3-acetic acid,2-5-bromo-1h-indol-3-yl acetic acid,5-bromo-1h-indol-3-yl-acetic acid,1h-indole-3-acetic acid, 5-bromo,5-bromo-1h-indol-3-yl acetic acid,5-bromo-3-indoleacetic acid,chembl82440,5-bromo-1h-indole-3-acetic acid,5-bromoindole-3-aceticacid,4ojq PubChem CID: 96734 IUPAC Name: 2-(5-bromo-1H-indol-3-yl)acetic acid SMILES: C1=CC2=C(C=C1Br)C(=CN2)CC(=O)O

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PubChem CID	96734
CAS	40432-84-6
Molecular Weight (g/mol)	254.083
MDL Number	MFCD00005637
SMILES	C1=CC2=C(C=C1Br)C(=CN2)CC(=O)O
Synonym	5-bromoindole-3-acetic acid,2-5-bromo-1h-indol-3-yl acetic acid,5-bromo-1h-indol-3-yl-acetic acid,1h-indole-3-acetic acid, 5-bromo,5-bromo-1h-indol-3-yl acetic acid,5-bromo-3-indoleacetic acid,chembl82440,5-bromo-1h-indole-3-acetic acid,5-bromoindole-3-aceticacid,4ojq
IUPAC Name	2-(5-bromo-1H-indol-3-yl)acetic acid
InChI Key	WTFGHMZUJMRWBK-UHFFFAOYSA-N
Molecular Formula	C10H8BrNO2

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2-Hydroxycarbazole, 97%

CAS: 86-79-3 Molecular Formula: C12H9NO Molecular Weight (g/mol): 183.21 MDL Number: MFCD00004962 InChI Key: GWPGDZPXOZATKL-UHFFFAOYSA-N Synonym: 2-hydroxycarbazole,carbazol-2-ol,ccris 5301,2-hydroxycarbazol,7-hydroxycarbazole,2-hydroxy carbazole,pubchem9945,pubchem9949,2-hydroxy-9h-carbazol,2-hydroxy-9h-carbazole PubChem CID: 93551 IUPAC Name: 9H-carbazol-2-ol SMILES: OC1=CC2=C(C=C1)C1=C(N2)C=CC=C1

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PubChem CID	93551
CAS	86-79-3
Molecular Weight (g/mol)	183.21
MDL Number	MFCD00004962
SMILES	OC1=CC2=C(C=C1)C1=C(N2)C=CC=C1
Synonym	2-hydroxycarbazole,carbazol-2-ol,ccris 5301,2-hydroxycarbazol,7-hydroxycarbazole,2-hydroxy carbazole,pubchem9945,pubchem9949,2-hydroxy-9h-carbazol,2-hydroxy-9h-carbazole
IUPAC Name	9H-carbazol-2-ol
InChI Key	GWPGDZPXOZATKL-UHFFFAOYSA-N
Molecular Formula	C12H9NO

TraceCERT™ Base-Neut Surrogate Spike Mix, Certified Reference Material, MilliporeSigma™ Supelco™

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.

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1-Indoleacetic acid, 95%

CAS: 24297-59-4 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.187 MDL Number: MFCD00047262 InChI Key: WQJFIWXYPKYBTO-UHFFFAOYSA-N Synonym: 1h-indole-1-acetic acid,2-1h-indol-1-yl acetic acid,indol-1-yl-acetic acid,indole-1-acetic acid,1h-indol-1-ylacetic acid,indol-1-ylacetic acid,indole-n-acetic acid,1-indoleacetic acid,pubchem20663,1-indolyl acetic acid PubChem CID: 90448 ChEBI: CHEBI:72814 IUPAC Name: 2-indol-1-ylacetic acid SMILES: C1=CC=C2C(=C1)C=CN2CC(=O)O

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PubChem CID	90448
CAS	24297-59-4
Molecular Weight (g/mol)	175.187
ChEBI	CHEBI:72814
MDL Number	MFCD00047262
SMILES	C1=CC=C2C(=C1)C=CN2CC(=O)O
Synonym	1h-indole-1-acetic acid,2-1h-indol-1-yl acetic acid,indol-1-yl-acetic acid,indole-1-acetic acid,1h-indol-1-ylacetic acid,indol-1-ylacetic acid,indole-n-acetic acid,1-indoleacetic acid,pubchem20663,1-indolyl acetic acid
IUPAC Name	2-indol-1-ylacetic acid
InChI Key	WQJFIWXYPKYBTO-UHFFFAOYSA-N
Molecular Formula	C10H9NO2

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2-(4-Chlorophenyl)indole, 98%

CAS: 1211-35-4 Molecular Formula: C14H10ClN Molecular Weight (g/mol): 227.691 MDL Number: MFCD00047159 InChI Key: KDNXKQSAAZNUCK-UHFFFAOYSA-N Synonym: 2-4-chlorophenyl-1h-indole,2-4-chlorophenyl indole,indole, 2-4-chlorophenyl,2-p-chlorophenyl indole,maybridge1_005860,2-p-chlorphenyl-indol,2-4-chlorophenyl-indole,2-4-chlorphenyl-1h-indole,1h-indole,2-4-chlorophenyl,2-4-chloro-phenyl-1h-indole PubChem CID: 220463 IUPAC Name: 2-(4-chlorophenyl)-1H-indole SMILES: C1=CC=C2C(=C1)C=C(N2)C3=CC=C(C=C3)Cl

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Specifications

PubChem CID	220463
CAS	1211-35-4
Molecular Weight (g/mol)	227.691
MDL Number	MFCD00047159
SMILES	C1=CC=C2C(=C1)C=C(N2)C3=CC=C(C=C3)Cl
Synonym	2-4-chlorophenyl-1h-indole,2-4-chlorophenyl indole,indole, 2-4-chlorophenyl,2-p-chlorophenyl indole,maybridge1_005860,2-p-chlorphenyl-indol,2-4-chlorophenyl-indole,2-4-chlorphenyl-1h-indole,1h-indole,2-4-chlorophenyl,2-4-chloro-phenyl-1h-indole
IUPAC Name	2-(4-chlorophenyl)-1H-indole
InChI Key	KDNXKQSAAZNUCK-UHFFFAOYSA-N
Molecular Formula	C14H10ClN

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2-(9-Carbazolyl)ethylboronic acid pinacol ester, 98%

CAS: 608534-41-4 Molecular Formula: C20H24BNO2 Molecular Weight (g/mol): 321.227 MDL Number: MFCD03788738 InChI Key: NTUZDLWSQJRXAM-UHFFFAOYSA-N Synonym: 2-9-carbazolyl ethylboronic acid pinacol ester,9-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl ethyl-9h-carbazole,9-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl ethyl carbazole,9-2-tetramethyl-1,3,2-dioxaborolan-2-yl ethyl carbazole,2-2-9h-carbazole-9-yl ethyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane PubChem CID: 45925651 IUPAC Name: 9-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethyl]carbazole SMILES: B1(OC(C(O1)(C)C)(C)C)CCN2C3=CC=CC=C3C4=CC=CC=C42

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PubChem CID	45925651
CAS	608534-41-4
Molecular Weight (g/mol)	321.227
MDL Number	MFCD03788738
SMILES	B1(OC(C(O1)(C)C)(C)C)CCN2C3=CC=CC=C3C4=CC=CC=C42
Synonym	2-9-carbazolyl ethylboronic acid pinacol ester,9-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl ethyl-9h-carbazole,9-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl ethyl carbazole,9-2-tetramethyl-1,3,2-dioxaborolan-2-yl ethyl carbazole,2-2-9h-carbazole-9-yl ethyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
IUPAC Name	9-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethyl]carbazole
InChI Key	NTUZDLWSQJRXAM-UHFFFAOYSA-N
Molecular Formula	C20H24BNO2

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Ethyl indole-3-acetate, 98+%

CAS: 778-82-5 Molecular Formula: C12H13NO2 Molecular Weight (g/mol): 203.241 MDL Number: MFCD00005635 InChI Key: HUDBDWIQSIGUDI-UHFFFAOYSA-N Synonym: ethyl 3-indoleacetate,ethyl 2-1h-indol-3-yl acetate,indole-3-acetic acid ethyl ester,ethyl indole-3-acetate,ethyl indol-3-ylacetate,1h-indole-3-acetic acid, ethyl ester,ethyl 1h-indol-3-ylacetate,indole-3-acetic acid, ethyl ester,ethyl beta-indolylacetate,ethyl3-indoleacetate PubChem CID: 13067 IUPAC Name: ethyl 2-(1H-indol-3-yl)acetate SMILES: CCOC(=O)CC1=CNC2=CC=CC=C21

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PubChem CID	13067
CAS	778-82-5
Molecular Weight (g/mol)	203.241
MDL Number	MFCD00005635
SMILES	CCOC(=O)CC1=CNC2=CC=CC=C21
Synonym	ethyl 3-indoleacetate,ethyl 2-1h-indol-3-yl acetate,indole-3-acetic acid ethyl ester,ethyl indole-3-acetate,ethyl indol-3-ylacetate,1h-indole-3-acetic acid, ethyl ester,ethyl 1h-indol-3-ylacetate,indole-3-acetic acid, ethyl ester,ethyl beta-indolylacetate,ethyl3-indoleacetate
IUPAC Name	ethyl 2-(1H-indol-3-yl)acetate
InChI Key	HUDBDWIQSIGUDI-UHFFFAOYSA-N
Molecular Formula	C12H13NO2

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3-(2-Aminoethyl)-5-bromoindole, 97%

CAS: 3610-42-2 Molecular Formula: C10H11BrN2 Molecular Weight (g/mol): 239.116 MDL Number: MFCD00130169 InChI Key: CGHUQJRRADEHTQ-UHFFFAOYSA-N PubChem CID: 77158 IUPAC Name: 2-(5-bromo-1H-indol-3-yl)ethanamine SMILES: C1=CC2=C(C=C1Br)C(=CN2)CCN

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Specifications

PubChem CID	77158
CAS	3610-42-2
Molecular Weight (g/mol)	239.116
MDL Number	MFCD00130169
SMILES	C1=CC2=C(C=C1Br)C(=CN2)CCN
IUPAC Name	2-(5-bromo-1H-indol-3-yl)ethanamine
InChI Key	CGHUQJRRADEHTQ-UHFFFAOYSA-N
Molecular Formula	C10H11BrN2

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1-Methyl-3-indolemethylamine, 96%

CAS: 19293-60-8 Molecular Formula: C10H12N2 Molecular Weight (g/mol): 160.22 MDL Number: MFCD06657101 InChI Key: NOFZMDGMQKRLIV-UHFFFAOYSA-N Synonym: 1-methyl-1h-indol-3-yl methanamine,1-methylindol-3-yl methanamine,1-methyl-3-indolemethylamine,1-methyl-1h-indol-3-yl-methylamine,1-methyl-1h-indol-3-yl methylamine,1-1-methyl-1h-indol-3-yl methanamine,c-1-methyl-1h-indol-3-yl-methylamine,1-1-methylindol-3-yl methanamine,n-methyl-3-aminomethyl-indol,1-methyl-1h-indole-3-methanamine PubChem CID: 3934542 IUPAC Name: (1-methylindol-3-yl)methanamine SMILES: CN1C=C(C2=CC=CC=C21)CN

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Specifications

PubChem CID	3934542
CAS	19293-60-8
Molecular Weight (g/mol)	160.22
MDL Number	MFCD06657101
SMILES	CN1C=C(C2=CC=CC=C21)CN
Synonym	1-methyl-1h-indol-3-yl methanamine,1-methylindol-3-yl methanamine,1-methyl-3-indolemethylamine,1-methyl-1h-indol-3-yl-methylamine,1-methyl-1h-indol-3-yl methylamine,1-1-methyl-1h-indol-3-yl methanamine,c-1-methyl-1h-indol-3-yl-methylamine,1-1-methylindol-3-yl methanamine,n-methyl-3-aminomethyl-indol,1-methyl-1h-indole-3-methanamine
IUPAC Name	(1-methylindol-3-yl)methanamine
InChI Key	NOFZMDGMQKRLIV-UHFFFAOYSA-N
Molecular Formula	C10H12N2

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4-Hydroxyindole, 98%

CAS: 2380-94-1 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00005667 InChI Key: NLMQHXUGJIAKTH-UHFFFAOYSA-N Synonym: 4-hydroxyindole,indol-4-ol,4-indolol,hydroxyindole,4-hydroxy-1h-indole,1h-indole-4-ol,4-hydroxy indole,unii-1w4vd9085v,hydroxyindoles,4-hydroxy-indole PubChem CID: 75421 ChEBI: CHEBI:24702 IUPAC Name: 1H-indol-4-ol SMILES: OC1=C2C=CNC2=CC=C1

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Specifications

PubChem CID	75421
CAS	2380-94-1
Molecular Weight (g/mol)	133.15
ChEBI	CHEBI:24702
MDL Number	MFCD00005667
SMILES	OC1=C2C=CNC2=CC=C1
Synonym	4-hydroxyindole,indol-4-ol,4-indolol,hydroxyindole,4-hydroxy-1h-indole,1h-indole-4-ol,4-hydroxy indole,unii-1w4vd9085v,hydroxyindoles,4-hydroxy-indole
IUPAC Name	1H-indol-4-ol
InChI Key	NLMQHXUGJIAKTH-UHFFFAOYSA-N
Molecular Formula	C8H7NO

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Thermo Scientific Chemicals Melatonine, 99%

CAS: 73-31-4 Molecular Formula: C₁₃H₁₆N₂O₂ Molecular Weight (g/mol): 232.28 MDL Number: MFCD00005655 InChI Key: DRLFMBDRBRZALE-UHFFFAOYSA-N Synonym: melatonin,melatonine,n-acetyl-5-methoxytryptamine,circadin,5-methoxy-n-acetyltryptamine,n-2-5-methoxy-1h-indol-3-yl ethyl acetamide,melatol,melatonex,melovine PubChem CID: 896 ChEBI: CHEBI:16796 IUPAC Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide SMILES: CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC

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Specifications

PubChem CID	896
CAS	73-31-4
Molecular Weight (g/mol)	232.28
ChEBI	CHEBI:16796
MDL Number	MFCD00005655
SMILES	CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC
Synonym	melatonin,melatonine,n-acetyl-5-methoxytryptamine,circadin,5-methoxy-n-acetyltryptamine,n-2-5-methoxy-1h-indol-3-yl ethyl acetamide,melatol,melatonex,melovine
IUPAC Name	N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
InChI Key	DRLFMBDRBRZALE-UHFFFAOYSA-N
Molecular Formula	C₁₃H₁₆N₂O₂

5-Hydroxy-2-indolecarboxylic acid, 98%

CAS: 21598-06-1 Molecular Formula: C9H6NO3 Molecular Weight (g/mol): 176.15 MDL Number: MFCD00005615 InChI Key: BIMHWDJKNOMNLD-UHFFFAOYSA-M Synonym: 5-hydroxyindole-2-carboxylic acid,5-hydroxy-2-indolecarboxylic acid,5-hydroxyindole-2-carboxylicacid,zlchem 754,pubchem1716,acmc-20am33,5-hydroxy-indole-2-carboxylic acid,5-hydroxy-1h-2-indolecarboxylic acid,indole-2-carboxylic acid, 5-hydroxy PubChem CID: 88958 IUPAC Name: 5-hydroxy-1H-indole-2-carboxylic acid SMILES: OC1=CC=C2NC(=CC2=C1)C([O-])=O

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PubChem CID	88958
CAS	21598-06-1
Molecular Weight (g/mol)	176.15
MDL Number	MFCD00005615
SMILES	OC1=CC=C2NC(=CC2=C1)C([O-])=O
Synonym	5-hydroxyindole-2-carboxylic acid,5-hydroxy-2-indolecarboxylic acid,5-hydroxyindole-2-carboxylicacid,zlchem 754,pubchem1716,acmc-20am33,5-hydroxy-indole-2-carboxylic acid,5-hydroxy-1h-2-indolecarboxylic acid,indole-2-carboxylic acid, 5-hydroxy
IUPAC Name	5-hydroxy-1H-indole-2-carboxylic acid
InChI Key	BIMHWDJKNOMNLD-UHFFFAOYSA-M
Molecular Formula	C9H6NO3

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