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Pyrroles

Aromatic organic heterocyclic compounds that consist of a five-membered ring with four carbon atoms and one nitrogen atom that forms an amine functional group.
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1 – 15 of 42 results
1

2-(1-Pyrrolyl)benzoic acid, 99%

CAS: 10333-68-3 Molecular Formula: C11H9NO2 Molecular Weight (g/mol): 187.20 MDL Number: MFCD00051645 InChI Key: GNWTWXOZRSBCOZ-UHFFFAOYSA-N Synonym: 2-1h-pyrrol-1-yl benzoic acid,2-1-pyrrolyl benzoic acid,1-2-carboxyphenyl pyrrole,2-pyrrol-1-yl benzoic acid,2-pyrrol-1-yl-benzoic acid,2-pyrrolylbenzoic acid,maybridge1_002677,1-o-carboxyphenyl pyrrole,n-2-carboxyphenyl pyrrole,1h-pyrrol-1-ylbenzoic acid PubChem CID: 728521 IUPAC Name: 2-pyrrol-1-ylbenzoic acid SMILES: OC(=O)C1=CC=CC=C1N1C=CC=C1

PubChem CID 728521
CAS 10333-68-3
Molecular Weight (g/mol) 187.20
MDL Number MFCD00051645
SMILES OC(=O)C1=CC=CC=C1N1C=CC=C1
Synonym 2-1h-pyrrol-1-yl benzoic acid,2-1-pyrrolyl benzoic acid,1-2-carboxyphenyl pyrrole,2-pyrrol-1-yl benzoic acid,2-pyrrol-1-yl-benzoic acid,2-pyrrolylbenzoic acid,maybridge1_002677,1-o-carboxyphenyl pyrrole,n-2-carboxyphenyl pyrrole,1h-pyrrol-1-ylbenzoic acid
IUPAC Name 2-pyrrol-1-ylbenzoic acid
InChI Key GNWTWXOZRSBCOZ-UHFFFAOYSA-N
Molecular Formula C11H9NO2
2

5-Bromo-1-methyl-1H-indole-3-carboxylic acid, 97%

CAS: 400071-95-6 Molecular Formula: C10H8BrNO2 Molecular Weight (g/mol): 254.08 MDL Number: MFCD14706162 InChI Key: WQZLFFJMRKTCMU-UHFFFAOYSA-N Synonym: 5-bromo-1-methyl-1h-indole-3-carboxylic acid,5-bromo-1-methyl-1h-indole-3-carboxylicacid,1h-indole-3-carboxylic acid, 5-bromo-1-methyl,ksc230c9b,5-bromo-1-methyl-1h-indole-3-carboxylic acid; PubChem CID: 11032413 IUPAC Name: 5-bromo-1-methylindole-3-carboxylic acid SMILES: CN1C=C(C2=C1C=CC(=C2)Br)C(=O)O

PubChem CID 11032413
CAS 400071-95-6
Molecular Weight (g/mol) 254.08
MDL Number MFCD14706162
SMILES CN1C=C(C2=C1C=CC(=C2)Br)C(=O)O
Synonym 5-bromo-1-methyl-1h-indole-3-carboxylic acid,5-bromo-1-methyl-1h-indole-3-carboxylicacid,1h-indole-3-carboxylic acid, 5-bromo-1-methyl,ksc230c9b,5-bromo-1-methyl-1h-indole-3-carboxylic acid;
IUPAC Name 5-bromo-1-methylindole-3-carboxylic acid
InChI Key WQZLFFJMRKTCMU-UHFFFAOYSA-N
Molecular Formula C10H8BrNO2
3

1-(4-Iodophenyl)pyrrole, 97%

CAS: 92636-36-7 Molecular Formula: C10H8IN Molecular Weight (g/mol): 269.085 MDL Number: MFCD00052399 InChI Key: FMURNAZHVQDQQN-UHFFFAOYSA-N Synonym: 1-4-iodophenyl pyrrole,1-4-iodophenyl-1h-pyrrole,acmc-20apaj,4-iodophenyl pyrrole,maybridge1_002926,1-4-iodo-phenyl-1h-pyrrole,1h-pyrrole,1-4-iodophenyl,1-4-iodophenyl-1h-pyrrole # PubChem CID: 272430 IUPAC Name: 1-(4-iodophenyl)pyrrole SMILES: C1=CN(C=C1)C2=CC=C(C=C2)I

PubChem CID 272430
CAS 92636-36-7
Molecular Weight (g/mol) 269.085
MDL Number MFCD00052399
SMILES C1=CN(C=C1)C2=CC=C(C=C2)I
Synonym 1-4-iodophenyl pyrrole,1-4-iodophenyl-1h-pyrrole,acmc-20apaj,4-iodophenyl pyrrole,maybridge1_002926,1-4-iodo-phenyl-1h-pyrrole,1h-pyrrole,1-4-iodophenyl,1-4-iodophenyl-1h-pyrrole #
IUPAC Name 1-(4-iodophenyl)pyrrole
InChI Key FMURNAZHVQDQQN-UHFFFAOYSA-N
Molecular Formula C10H8IN
4

1-Benzylindole-3-carboxylic acid, 95%

CAS: 27018-76-4 Molecular Formula: C16H13NO2 Molecular Weight (g/mol): 251.285 MDL Number: MFCD00057094 InChI Key: LVYDDRHDOKXFMW-UHFFFAOYSA-N Synonym: 1-benzyl-1h-indole-3-carboxylic acid,indole-3-carboxylic acid, 1-benzyl,1h-indole-3-carboxylic acid, 1-phenylmethyl,pubchem7313,cbmicro_033327,cambridge id 5791025,5-22-03-00037 beilstein handbook reference,1-benzylindol-3-carboxylic acid,n-benzylindole-3-carboxylic acid,1h-indole-3-carboxylicacid, 1-phenylmethyl PubChem CID: 33671 IUPAC Name: 1-benzylindole-3-carboxylic acid SMILES: C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C(=O)O

PubChem CID 33671
CAS 27018-76-4
Molecular Weight (g/mol) 251.285
MDL Number MFCD00057094
SMILES C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C(=O)O
Synonym 1-benzyl-1h-indole-3-carboxylic acid,indole-3-carboxylic acid, 1-benzyl,1h-indole-3-carboxylic acid, 1-phenylmethyl,pubchem7313,cbmicro_033327,cambridge id 5791025,5-22-03-00037 beilstein handbook reference,1-benzylindol-3-carboxylic acid,n-benzylindole-3-carboxylic acid,1h-indole-3-carboxylicacid, 1-phenylmethyl
IUPAC Name 1-benzylindole-3-carboxylic acid
InChI Key LVYDDRHDOKXFMW-UHFFFAOYSA-N
Molecular Formula C16H13NO2
5

3-(1H-Pyrrol-1-yl)aniline, 97%, Thermo Scientific™

CAS: 89353-42-4 Molecular Formula: C10H10N2 Molecular Weight (g/mol): 158.204 MDL Number: MFCD03407309 InChI Key: PJGDCPOPSNUYHC-UHFFFAOYSA-N Synonym: 3-1h-pyrrol-1-yl aniline,3-pyrrol-1-yl-phenylamine,3-pyrrol-1-yl aniline,3-pyrrolylphenylamine,3-1-pyrrolyl aniline,3-pyrrol-1-yl-aniline,1-3-aminophenyl pyrrole,benzenamine, 3-1h-pyrrol-1-yl PubChem CID: 2760546 IUPAC Name: 3-pyrrol-1-ylaniline SMILES: C1=CN(C=C1)C2=CC(=CC=C2)N

PubChem CID 2760546
CAS 89353-42-4
Molecular Weight (g/mol) 158.204
MDL Number MFCD03407309
SMILES C1=CN(C=C1)C2=CC(=CC=C2)N
Synonym 3-1h-pyrrol-1-yl aniline,3-pyrrol-1-yl-phenylamine,3-pyrrol-1-yl aniline,3-pyrrolylphenylamine,3-1-pyrrolyl aniline,3-pyrrol-1-yl-aniline,1-3-aminophenyl pyrrole,benzenamine, 3-1h-pyrrol-1-yl
IUPAC Name 3-pyrrol-1-ylaniline
InChI Key PJGDCPOPSNUYHC-UHFFFAOYSA-N
Molecular Formula C10H10N2
6

2-(2,5-Dimethyl-1H-pyrrol-1-yl)benzoic acid, 97%, Thermo Scientific™

CAS: 92028-57-4 Molecular Formula: C13H13NO2 Molecular Weight (g/mol): 215.25 MDL Number: MFCD01125264 InChI Key: ZLYUUANOICYAAL-UHFFFAOYSA-N Synonym: 2-2,5-dimethyl-1h-pyrrol-1-yl benzoic acid,2-2,5-dimethylpyrrol-1-yl benzoic acid,2-2,5-dimethyl-1-pyrrolyl benzoic acid,2-2,5-dimethyl-pyrrol-1-yl-benzoic acid,2-2,5-dimethylpyrrolyl benzoic acid,cbmicro_048042,benzoic acid,2-2,5-dimethyl-1h-pyrrol-1-yl PubChem CID: 292956 IUPAC Name: 2-(2,5-dimethylpyrrol-1-yl)benzoic acid SMILES: CC1=CC=C(C)N1C1=CC=CC=C1C(O)=O

PubChem CID 292956
CAS 92028-57-4
Molecular Weight (g/mol) 215.25
MDL Number MFCD01125264
SMILES CC1=CC=C(C)N1C1=CC=CC=C1C(O)=O
Synonym 2-2,5-dimethyl-1h-pyrrol-1-yl benzoic acid,2-2,5-dimethylpyrrol-1-yl benzoic acid,2-2,5-dimethyl-1-pyrrolyl benzoic acid,2-2,5-dimethyl-pyrrol-1-yl-benzoic acid,2-2,5-dimethylpyrrolyl benzoic acid,cbmicro_048042,benzoic acid,2-2,5-dimethyl-1h-pyrrol-1-yl
IUPAC Name 2-(2,5-dimethylpyrrol-1-yl)benzoic acid
InChI Key ZLYUUANOICYAAL-UHFFFAOYSA-N
Molecular Formula C13H13NO2
7

Pyrrole-3-carboxylic acid hydrate, 95%

CAS: 336100-46-0 Molecular Formula: C5H5NO2 Molecular Weight (g/mol): 111.10 MDL Number: MFCD06201862 InChI Key: DOYOPBSXEIZLRE-UHFFFAOYSA-N Synonym: pyrrole-3-carboxylic acid hydrate,1h-pyrrole-3-carboxylic acid hydrate,c5h5no2.h2o,1h-pyrrole-3-carboxylicacid, hydrate 1:? PubChem CID: 45076181 IUPAC Name: 1H-pyrrole-3-carboxylic acid;hydrate SMILES: OC(=O)C1=CNC=C1

PubChem CID 45076181
CAS 336100-46-0
Molecular Weight (g/mol) 111.10
MDL Number MFCD06201862
SMILES OC(=O)C1=CNC=C1
Synonym pyrrole-3-carboxylic acid hydrate,1h-pyrrole-3-carboxylic acid hydrate,c5h5no2.h2o,1h-pyrrole-3-carboxylicacid, hydrate 1:?
IUPAC Name 1H-pyrrole-3-carboxylic acid;hydrate
InChI Key DOYOPBSXEIZLRE-UHFFFAOYSA-N
Molecular Formula C5H5NO2
8

4-(2,5-Dimethyl-1-pyrrolyl)benzonitrile, 98%

CAS: 119516-86-8 Molecular Formula: C13H12N2 Molecular Weight (g/mol): 196.253 InChI Key: FNDFKQYZEDOHRC-UHFFFAOYSA-N Synonym: 1-4-cyanophenyl-2,5-dimethylpyrrole,4-2,5-dimethylpyrrol-1-yl benzonitrile,4-2,5-dimethyl-1h-pyrrol-1-yl benzonitrile,2,5-dimethyl-1-4-cyanophenyl pyrrole,n-4'-cyanophenyl-2,5-dimethylpyrrole,4-2,5-dimethyl-1-pyrrolyl benzonitrile,benzonitrile,4-2,5-dimethyl-1h-pyrrol-1-yl PubChem CID: 3787857 IUPAC Name: 4-(2,5-dimethylpyrrol-1-yl)benzonitrile SMILES: CC1=CC=C(N1C2=CC=C(C=C2)C#N)C

PubChem CID 3787857
CAS 119516-86-8
Molecular Weight (g/mol) 196.253
SMILES CC1=CC=C(N1C2=CC=C(C=C2)C#N)C
Synonym 1-4-cyanophenyl-2,5-dimethylpyrrole,4-2,5-dimethylpyrrol-1-yl benzonitrile,4-2,5-dimethyl-1h-pyrrol-1-yl benzonitrile,2,5-dimethyl-1-4-cyanophenyl pyrrole,n-4'-cyanophenyl-2,5-dimethylpyrrole,4-2,5-dimethyl-1-pyrrolyl benzonitrile,benzonitrile,4-2,5-dimethyl-1h-pyrrol-1-yl
IUPAC Name 4-(2,5-dimethylpyrrol-1-yl)benzonitrile
InChI Key FNDFKQYZEDOHRC-UHFFFAOYSA-N
Molecular Formula C13H12N2
9

Pyrrole-3-carboxylic acid, 98+%

CAS: 931-03-3 Molecular Formula: C5H5NO2 Molecular Weight (g/mol): 111.1 MDL Number: MFCD00800594 InChI Key: DOYOPBSXEIZLRE-UHFFFAOYSA-N Synonym: pyrrole-3-carboxylic acid,pyrrole-3-carboxylicacid,3-carboxy-1h-pyrrole,1h-pyrrole-3-carboxylicacid,pubchem8345,3-carboxypyrrole,3-pyrrolecarboxylic acid,acmc-1agqb,3-pyrrole-carboxylic acid,pyrrole 3-carboxylic acid PubChem CID: 101030 ChEBI: CHEBI:68076 IUPAC Name: 1H-pyrrole-3-carboxylic acid SMILES: C1=CNC=C1C(=O)O

PubChem CID 101030
CAS 931-03-3
Molecular Weight (g/mol) 111.1
ChEBI CHEBI:68076
MDL Number MFCD00800594
SMILES C1=CNC=C1C(=O)O
Synonym pyrrole-3-carboxylic acid,pyrrole-3-carboxylicacid,3-carboxy-1h-pyrrole,1h-pyrrole-3-carboxylicacid,pubchem8345,3-carboxypyrrole,3-pyrrolecarboxylic acid,acmc-1agqb,3-pyrrole-carboxylic acid,pyrrole 3-carboxylic acid
IUPAC Name 1H-pyrrole-3-carboxylic acid
InChI Key DOYOPBSXEIZLRE-UHFFFAOYSA-N
Molecular Formula C5H5NO2
10

Thermo Scientific Chemicals Atorvastatin calcium trihydrate

CAS: 344423-98-9 Molecular Formula: C66H74CaF2N4O13 Molecular Weight (g/mol): 1209.41 InChI Key: SHZPNDRIDUBNMH-NIJVSVLQSA-L IUPAC Name: calcium bis((3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate) trihydrate SMILES: O.O.O.[Ca++].CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1.CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1

CAS 344423-98-9
Molecular Weight (g/mol) 1209.41
SMILES O.O.O.[Ca++].CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1.CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C1=CC=C(F)C=C1)C1=CC=CC=C1
IUPAC Name calcium bis((3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate) trihydrate
InChI Key SHZPNDRIDUBNMH-NIJVSVLQSA-L
Molecular Formula C66H74CaF2N4O13
11

Indole-3-carboxylic acid, 98%

CAS: 771-50-6 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD00005624 InChI Key: KMAKOBLIOCQGJP-UHFFFAOYSA-N Synonym: indole-3-carboxylic acid,3-indoleformic acid,3-carboxyindole,indole-3-carboxylicacid,3-indolecarboxylic acid,indole-3-carboxylate,3-indolylcarboxylic acid,beta-indolylcarboxylic acid,indole-3 carboxylic acid,ico PubChem CID: 69867 ChEBI: CHEBI:24809 IUPAC Name: 1H-indole-3-carboxylic acid SMILES: C1=CC=C2C(=C1)C(=CN2)C(=O)O

PubChem CID 69867
CAS 771-50-6
Molecular Weight (g/mol) 161.16
ChEBI CHEBI:24809
MDL Number MFCD00005624
SMILES C1=CC=C2C(=C1)C(=CN2)C(=O)O
Synonym indole-3-carboxylic acid,3-indoleformic acid,3-carboxyindole,indole-3-carboxylicacid,3-indolecarboxylic acid,indole-3-carboxylate,3-indolylcarboxylic acid,beta-indolylcarboxylic acid,indole-3 carboxylic acid,ico
IUPAC Name 1H-indole-3-carboxylic acid
InChI Key KMAKOBLIOCQGJP-UHFFFAOYSA-N
Molecular Formula C9H7NO2
12

Indole-3-carboxylic acid, 99%

CAS: 771-50-6 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD00005624 InChI Key: KMAKOBLIOCQGJP-UHFFFAOYSA-N Synonym: indole-3-carboxylic acid,3-indoleformic acid,3-carboxyindole,indole-3-carboxylicacid,3-indolecarboxylic acid,indole-3-carboxylate,3-indolylcarboxylic acid,beta-indolylcarboxylic acid,indole-3 carboxylic acid,ico PubChem CID: 69867 ChEBI: CHEBI:24809 IUPAC Name: 1H-indole-3-carboxylic acid SMILES: C1=CC=C2C(=C1)C(=CN2)C(=O)O

PubChem CID 69867
CAS 771-50-6
Molecular Weight (g/mol) 161.16
ChEBI CHEBI:24809
MDL Number MFCD00005624
SMILES C1=CC=C2C(=C1)C(=CN2)C(=O)O
Synonym indole-3-carboxylic acid,3-indoleformic acid,3-carboxyindole,indole-3-carboxylicacid,3-indolecarboxylic acid,indole-3-carboxylate,3-indolylcarboxylic acid,beta-indolylcarboxylic acid,indole-3 carboxylic acid,ico
IUPAC Name 1H-indole-3-carboxylic acid
InChI Key KMAKOBLIOCQGJP-UHFFFAOYSA-N
Molecular Formula C9H7NO2
13

Ethyl 4-phenylpyrrole-3-carboxylate, 97%

CAS: 64276-62-6 Molecular Formula: C13H13NO2 Molecular Weight (g/mol): 215.252 MDL Number: MFCD03931521 InChI Key: VNZGRYAVCWGZCT-UHFFFAOYSA-N Synonym: ethyl 4-phenylpyrrole-3-carboxylate,4-phenyl-1h-pyrrole-3-carboxylic acid ethyl ester,4-phenylpyrrole-3-carboxylic acid ethyl ester,acmc-20akyb,3-carboethoxy-4-phenylpyrrole,3-carbethoxy-4-phenylpyrrole,ethyl4-phenyl-1h-pyrrole-3-carboxylate,1h-pyrrole-3-carboxylicacid, 4-phenyl-, ethyl ester PubChem CID: 4154165 IUPAC Name: ethyl 4-phenyl-1H-pyrrole-3-carboxylate SMILES: CCOC(=O)C1=CNC=C1C2=CC=CC=C2

PubChem CID 4154165
CAS 64276-62-6
Molecular Weight (g/mol) 215.252
MDL Number MFCD03931521
SMILES CCOC(=O)C1=CNC=C1C2=CC=CC=C2
Synonym ethyl 4-phenylpyrrole-3-carboxylate,4-phenyl-1h-pyrrole-3-carboxylic acid ethyl ester,4-phenylpyrrole-3-carboxylic acid ethyl ester,acmc-20akyb,3-carboethoxy-4-phenylpyrrole,3-carbethoxy-4-phenylpyrrole,ethyl4-phenyl-1h-pyrrole-3-carboxylate,1h-pyrrole-3-carboxylicacid, 4-phenyl-, ethyl ester
IUPAC Name ethyl 4-phenyl-1H-pyrrole-3-carboxylate
InChI Key VNZGRYAVCWGZCT-UHFFFAOYSA-N
Molecular Formula C13H13NO2
14

2,5-Dimethylpyrrole-3-carboxylic acid, 97%

CAS: 57338-76-8 Molecular Formula: C7H9NO2 Molecular Weight (g/mol): 139.154 MDL Number: MFCD00203874 InChI Key: VDVWTJFVFQVCFN-UHFFFAOYSA-N Synonym: 2,5-dimethylpyrrole-3-carboxylic acid,1h-pyrrole-3-carboxylic acid, 2,5-dimethyl,2,5-dimethyl-4-carboxypyrrole,1h-pyrrole-3-carboxylicacid, 2,5-dimethyl PubChem CID: 292957 IUPAC Name: 2,5-dimethyl-1H-pyrrole-3-carboxylic acid SMILES: CC1=CC(=C(N1)C)C(=O)O

PubChem CID 292957
CAS 57338-76-8
Molecular Weight (g/mol) 139.154
MDL Number MFCD00203874
SMILES CC1=CC(=C(N1)C)C(=O)O
Synonym 2,5-dimethylpyrrole-3-carboxylic acid,1h-pyrrole-3-carboxylic acid, 2,5-dimethyl,2,5-dimethyl-4-carboxypyrrole,1h-pyrrole-3-carboxylicacid, 2,5-dimethyl
IUPAC Name 2,5-dimethyl-1H-pyrrole-3-carboxylic acid
InChI Key VDVWTJFVFQVCFN-UHFFFAOYSA-N
Molecular Formula C7H9NO2
15

5-Bromo-2-phenyl-7-azaindole, 97%, Thermo Scientific Chemicals

CAS: 953414-75-0 Molecular Formula: C13H9BrN2 Molecular Weight (g/mol): 273.13 MDL Number: MFCD11109822 InChI Key: QLKZJMXSXCDCCF-UHFFFAOYSA-N Synonym: 5-bromo-2-phenyl-1h-pyrrolo 2,3-b pyridine,5-bromo-2-phenyl-7-azaindole,1h-pyrrolo 2,3-b pyridine,5-bromo-2-phenyl,2-phenyl-5-bromo-1h-pyrrolo 2,3-b pyridine PubChem CID: 23643607 IUPAC Name: 5-bromo-2-phenyl-1H-pyrrolo[2,3-b]pyridine SMILES: BrC1=CN=C2NC(=CC2=C1)C1=CC=CC=C1

PubChem CID 23643607
CAS 953414-75-0
Molecular Weight (g/mol) 273.13
MDL Number MFCD11109822
SMILES BrC1=CN=C2NC(=CC2=C1)C1=CC=CC=C1
Synonym 5-bromo-2-phenyl-1h-pyrrolo 2,3-b pyridine,5-bromo-2-phenyl-7-azaindole,1h-pyrrolo 2,3-b pyridine,5-bromo-2-phenyl,2-phenyl-5-bromo-1h-pyrrolo 2,3-b pyridine
IUPAC Name 5-bromo-2-phenyl-1H-pyrrolo[2,3-b]pyridine
InChI Key QLKZJMXSXCDCCF-UHFFFAOYSA-N
Molecular Formula C13H9BrN2