Organoheterocyclic compounds
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5,5'-Dibromo-2,2'-bithiophene, 98%
CAS: 4805-22-5 Molecular Formula: C8H4Br2S2 Molecular Weight (g/mol): 324.048 MDL Number: MFCD00219110 InChI Key: SXNCMLQAQIGJDO-UHFFFAOYSA-N Synonym: 5,5'-dibromo-2,2'-bithiophene,2-bromo-5-5-bromothiophen-2-yl thiophene,5,5-dibromo-2,2-bithiophene,2,2'-bithiophene, 5,5'-dibromo,5,5'-bis 2-bromothiophene,5,5'-dibromo-2,2'bithiophene,5,5'-dibromo-2,2-bithiophene,maybridge4_002009,acmc-209kc4,ksc491i4r PubChem CID: 638908 IUPAC Name: 2-bromo-5-(5-bromothiophen-2-yl)thiophene SMILES: C1=C(SC(=C1)Br)C2=CC=C(S2)Br
| PubChem CID | 638908 |
|---|---|
| CAS | 4805-22-5 |
| Molecular Weight (g/mol) | 324.048 |
| MDL Number | MFCD00219110 |
| SMILES | C1=C(SC(=C1)Br)C2=CC=C(S2)Br |
| Synonym | 5,5'-dibromo-2,2'-bithiophene,2-bromo-5-5-bromothiophen-2-yl thiophene,5,5-dibromo-2,2-bithiophene,2,2'-bithiophene, 5,5'-dibromo,5,5'-bis 2-bromothiophene,5,5'-dibromo-2,2'bithiophene,5,5'-dibromo-2,2-bithiophene,maybridge4_002009,acmc-209kc4,ksc491i4r |
| IUPAC Name | 2-bromo-5-(5-bromothiophen-2-yl)thiophene |
| InChI Key | SXNCMLQAQIGJDO-UHFFFAOYSA-N |
| Molecular Formula | C8H4Br2S2 |
N-Boc-L-beta-proline, 95%, Thermo Scientific Chemicals
CAS: 140148-70-5 Molecular Formula: C10H17NO4 Molecular Weight (g/mol): 215.249 MDL Number: MFCD03094728 InChI Key: HRMRQBJUFWFQLX-ZETCQYMHSA-N Synonym: s-1-boc-pyrrolidine-3-carboxylic acid,s-1-n-boc-beta-proline,s-1-tert-butoxycarbonyl pyrrolidine-3-carboxylic acid,n-boc-l-beta-proline,3s-1-tert-butoxycarbonyl-3-pyrrolidinecarboxylic acid,s-n-boc-pyrrolidine-3-carboxylic acid,3s-boc-beta-pro-oh,3s-1-boc-pyrrolidine-3-carboxylic acid,boc-3s-1-pyrrolidine-3-carboxylic acid PubChem CID: 1512492 IUPAC Name: (3S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid SMILES: CC(C)(C)OC(=O)N1CCC(C1)C(=O)O
| PubChem CID | 1512492 |
|---|---|
| CAS | 140148-70-5 |
| Molecular Weight (g/mol) | 215.249 |
| MDL Number | MFCD03094728 |
| SMILES | CC(C)(C)OC(=O)N1CCC(C1)C(=O)O |
| Synonym | s-1-boc-pyrrolidine-3-carboxylic acid,s-1-n-boc-beta-proline,s-1-tert-butoxycarbonyl pyrrolidine-3-carboxylic acid,n-boc-l-beta-proline,3s-1-tert-butoxycarbonyl-3-pyrrolidinecarboxylic acid,s-n-boc-pyrrolidine-3-carboxylic acid,3s-boc-beta-pro-oh,3s-1-boc-pyrrolidine-3-carboxylic acid,boc-3s-1-pyrrolidine-3-carboxylic acid |
| IUPAC Name | (3S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid |
| InChI Key | HRMRQBJUFWFQLX-ZETCQYMHSA-N |
| Molecular Formula | C10H17NO4 |
2,1,3-Benzoxadiazol-4-amine, 97%, Thermo Scientific™
CAS: 767-63-5 Molecular Formula: C6H5N3O Molecular Weight (g/mol): 135.126 MDL Number: MFCD00168448 InChI Key: IPCMVRZVNJHUHR-UHFFFAOYSA-N Synonym: 4-aminobenzofurazan,benzo 1,2,5 oxadiazol-4-ylamine,2,1,3-benzooxadiazol-4-ylamine,benzo c 1,2,5-oxadiazole-4-ylamine,benzofurazan-4-amine,benzofurazane-4-amine,acmc-209p5u,2,1,3-benzoxadiazol-7-amine,2,1,3-benzoxadiazol-4-ylamine,benzo c 1,2,5 oxadiazol-4-amine PubChem CID: 584570 IUPAC Name: 2,1,3-benzoxadiazol-4-amine SMILES: C1=CC2=NON=C2C(=C1)N
| PubChem CID | 584570 |
|---|---|
| CAS | 767-63-5 |
| Molecular Weight (g/mol) | 135.126 |
| MDL Number | MFCD00168448 |
| SMILES | C1=CC2=NON=C2C(=C1)N |
| Synonym | 4-aminobenzofurazan,benzo 1,2,5 oxadiazol-4-ylamine,2,1,3-benzooxadiazol-4-ylamine,benzo c 1,2,5-oxadiazole-4-ylamine,benzofurazan-4-amine,benzofurazane-4-amine,acmc-209p5u,2,1,3-benzoxadiazol-7-amine,2,1,3-benzoxadiazol-4-ylamine,benzo c 1,2,5 oxadiazol-4-amine |
| IUPAC Name | 2,1,3-benzoxadiazol-4-amine |
| InChI Key | IPCMVRZVNJHUHR-UHFFFAOYSA-N |
| Molecular Formula | C6H5N3O |
ethyle4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate, 97%, Thermo Scientific™
CAS: 720-01-4 Molecular Formula: C8H6ClF3N2O2 Molecular Weight (g/mol): 254.59 MDL Number: MFCD00173897 InChI Key: DSULCDCBENGHAX-UHFFFAOYSA-N Synonym: ethyl 4-chloro-2-trifluoromethyl pyrimidine-5-carboxylate,4-chloro-2-trifluoromethyl-pyrimidine-5-carboxylic acid ethyl ester,5-pyrimidinecarboxylic acid, 4-chloro-2-trifluoromethyl-, ethyl ester,4-chloro-2-trifluoromethyl-pyrimidine-5-carboxylicacidethylester,ethyl 2-trifluoromethyl-4-chloropyrimidine-5-carboxylate,ethyl 4-chloro-2-trifluoromethyl pyrimidine-5-car,ethyl 4-chloro-2-trifluoromethyl-pyrimidine-5-carboxylate,ethyl-4-chloro-2-trifluoromethyl pyrimidine-5-carboxylate,5-pyrimidinecarboxylicacid, 4-chloro-2-trifluoromethyl-, ethyl ester PubChem CID: 2737166 IUPAC Name: ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate SMILES: CCOC(=O)C1=CN=C(N=C1Cl)C(F)(F)F
| PubChem CID | 2737166 |
|---|---|
| CAS | 720-01-4 |
| Molecular Weight (g/mol) | 254.59 |
| MDL Number | MFCD00173897 |
| SMILES | CCOC(=O)C1=CN=C(N=C1Cl)C(F)(F)F |
| Synonym | ethyl 4-chloro-2-trifluoromethyl pyrimidine-5-carboxylate,4-chloro-2-trifluoromethyl-pyrimidine-5-carboxylic acid ethyl ester,5-pyrimidinecarboxylic acid, 4-chloro-2-trifluoromethyl-, ethyl ester,4-chloro-2-trifluoromethyl-pyrimidine-5-carboxylicacidethylester,ethyl 2-trifluoromethyl-4-chloropyrimidine-5-carboxylate,ethyl 4-chloro-2-trifluoromethyl pyrimidine-5-car,ethyl 4-chloro-2-trifluoromethyl-pyrimidine-5-carboxylate,ethyl-4-chloro-2-trifluoromethyl pyrimidine-5-carboxylate,5-pyrimidinecarboxylicacid, 4-chloro-2-trifluoromethyl-, ethyl ester |
| IUPAC Name | ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate |
| InChI Key | DSULCDCBENGHAX-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClF3N2O2 |
5-Amino-3-(4-methoxyphenyl)-1H-pyrazole, 97%
CAS: 19541-95-8 Molecular Formula: C10H11N3O Molecular Weight (g/mol): 189.218 MDL Number: MFCD00462192 InChI Key: UPAGEJODHNVJNM-UHFFFAOYSA-N Synonym: 3-4-methoxyphenyl-1h-pyrazol-5-amine,5-4-methoxyphenyl-1h-pyrazol-3-amine,3-amino-5-4-methoxyphenyl pyrazole,5-amino-3-4-methoxyphenyl pyrazole,3-amino-5-4-methoxyphenyl-1h-pyrazole,5-4-methoxy-phenyl-2h-pyrazol-3-ylamine,5-amino-3-4-methoxyphenyl-1h-pyrazole,1h-pyrazol-3-amine, 5-4-methoxyphenyl,5-4-methoxyphenyl-2h-pyrazol-3-amine,5-4-methoxyphenyl-2h-pyrazol-3-ylamine PubChem CID: 2756469 IUPAC Name: 5-(4-methoxyphenyl)-1H-pyrazol-3-amine SMILES: COC1=CC=C(C=C1)C2=CC(=NN2)N
| PubChem CID | 2756469 |
|---|---|
| CAS | 19541-95-8 |
| Molecular Weight (g/mol) | 189.218 |
| MDL Number | MFCD00462192 |
| SMILES | COC1=CC=C(C=C1)C2=CC(=NN2)N |
| Synonym | 3-4-methoxyphenyl-1h-pyrazol-5-amine,5-4-methoxyphenyl-1h-pyrazol-3-amine,3-amino-5-4-methoxyphenyl pyrazole,5-amino-3-4-methoxyphenyl pyrazole,3-amino-5-4-methoxyphenyl-1h-pyrazole,5-4-methoxy-phenyl-2h-pyrazol-3-ylamine,5-amino-3-4-methoxyphenyl-1h-pyrazole,1h-pyrazol-3-amine, 5-4-methoxyphenyl,5-4-methoxyphenyl-2h-pyrazol-3-amine,5-4-methoxyphenyl-2h-pyrazol-3-ylamine |
| IUPAC Name | 5-(4-methoxyphenyl)-1H-pyrazol-3-amine |
| InChI Key | UPAGEJODHNVJNM-UHFFFAOYSA-N |
| Molecular Formula | C10H11N3O |
2,5-Dimethylthiophene, 98.5%
CAS: 638-02-8 Molecular Formula: C6H8S Molecular Weight (g/mol): 112.19 MDL Number: MFCD00005452 InChI Key: GWQOOADXMVQEFT-UHFFFAOYSA-N PubChem CID: 12514 IUPAC Name: 2,5-dimethylthiophene SMILES: CC1=CC=C(S1)C
| PubChem CID | 12514 |
|---|---|
| CAS | 638-02-8 |
| Molecular Weight (g/mol) | 112.19 |
| MDL Number | MFCD00005452 |
| SMILES | CC1=CC=C(S1)C |
| IUPAC Name | 2,5-dimethylthiophene |
| InChI Key | GWQOOADXMVQEFT-UHFFFAOYSA-N |
| Molecular Formula | C6H8S |
3,4-(Methylenedioxy)phenylacetic acid, 98%
CAS: 2861-28-1 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.159 MDL Number: MFCD00014576 InChI Key: ODVLMCWNGKLROU-UHFFFAOYSA-N Synonym: 1,3-benzodioxole-5-acetic acid,3,4-methylenedioxy phenylacetic acid,2-benzo d 1,3 dioxol-5-yl acetic acid,3,4-methylenedioxyphenylacetic acid,homopiperonylic acid,benzo-1,3-dioxole-5-acetic acid,1,3-benzodioxol-5-yl acetic acid,2-2h-1,3-benzodioxol-5-yl acetic acid,2-1,3-benzodioxol-5-yl acetic acid,1,3-benzodioxol-5-ylacetic acid PubChem CID: 76115 IUPAC Name: 2-(1,3-benzodioxol-5-yl)acetic acid SMILES: C1OC2=C(O1)C=C(C=C2)CC(=O)O
| PubChem CID | 76115 |
|---|---|
| CAS | 2861-28-1 |
| Molecular Weight (g/mol) | 180.159 |
| MDL Number | MFCD00014576 |
| SMILES | C1OC2=C(O1)C=C(C=C2)CC(=O)O |
| Synonym | 1,3-benzodioxole-5-acetic acid,3,4-methylenedioxy phenylacetic acid,2-benzo d 1,3 dioxol-5-yl acetic acid,3,4-methylenedioxyphenylacetic acid,homopiperonylic acid,benzo-1,3-dioxole-5-acetic acid,1,3-benzodioxol-5-yl acetic acid,2-2h-1,3-benzodioxol-5-yl acetic acid,2-1,3-benzodioxol-5-yl acetic acid,1,3-benzodioxol-5-ylacetic acid |
| IUPAC Name | 2-(1,3-benzodioxol-5-yl)acetic acid |
| InChI Key | ODVLMCWNGKLROU-UHFFFAOYSA-N |
| Molecular Formula | C9H8O4 |
Adenine Hemisulfate Dihydrate, ≥99%, MP Biomedicals™
CAS: 6509-19-9 Molecular Formula: C10H16N10O6S Molecular Weight (g/mol): 404.36 MDL Number: MFCD00150149 InChI Key: MKPCNMXYTMQZBE-UHFFFAOYSA-N Synonym: 9h-purin-6-amine hemisulfate dihydrate,adenine hemisulfate dihydrate,6-aminopurine sulfate dihydrate,bis ade sulfuric acid dihydrate,sulfuric acid bis vitamin b4 dihydrate,bis adenine sulfuric acid dihydrate,sulfuric acid-7h-purin-6-amine-water 1/2/2 PubChem CID: 44134512 IUPAC Name: bis(7H-purin-6-amine) sulfuric acid dihydrate SMILES: O.O.OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1
| PubChem CID | 44134512 |
|---|---|
| CAS | 6509-19-9 |
| Molecular Weight (g/mol) | 404.36 |
| MDL Number | MFCD00150149 |
| SMILES | O.O.OS(O)(=O)=O.NC1=C2NC=NC2=NC=N1.NC1=C2NC=NC2=NC=N1 |
| Synonym | 9h-purin-6-amine hemisulfate dihydrate,adenine hemisulfate dihydrate,6-aminopurine sulfate dihydrate,bis ade sulfuric acid dihydrate,sulfuric acid bis vitamin b4 dihydrate,bis adenine sulfuric acid dihydrate,sulfuric acid-7h-purin-6-amine-water 1/2/2 |
| IUPAC Name | bis(7H-purin-6-amine) sulfuric acid dihydrate |
| InChI Key | MKPCNMXYTMQZBE-UHFFFAOYSA-N |
| Molecular Formula | C10H16N10O6S |
Methyl 6-chloronicotinate, 98%
CAS: 73781-91-6 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00023420 InChI Key: RMEDXVIWDFLGES-UHFFFAOYSA-N PubChem CID: 254249 IUPAC Name: methyl 6-chloropyridine-3-carboxylate SMILES: COC(=O)C1=CN=C(C=C1)Cl
| PubChem CID | 254249 |
|---|---|
| CAS | 73781-91-6 |
| Molecular Weight (g/mol) | 171.58 |
| MDL Number | MFCD00023420 |
| SMILES | COC(=O)C1=CN=C(C=C1)Cl |
| IUPAC Name | methyl 6-chloropyridine-3-carboxylate |
| InChI Key | RMEDXVIWDFLGES-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClNO2 |
delta-Decanolactone, 97%
CAS: 705-86-2 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.25 MDL Number: MFCD00006649 InChI Key: GHBSPIPJMLAMEP-UHFFFAOYNA-N Synonym: delta-decalactone,6-pentyltetrahydro-2h-pyran-2-one,5-decanolide,decanolide-1,5,5-decalactone,decan-5-olide,amyl-delta-valerolactone,delta-decanolactone,5-pentyl-5-pentanolide,2h-pyran-2-one, tetrahydro-6-pentyl PubChem CID: 12810 ChEBI: CHEBI:87327 IUPAC Name: 6-pentyloxan-2-one SMILES: CCCCCC1CCCC(=O)O1
| PubChem CID | 12810 |
|---|---|
| CAS | 705-86-2 |
| Molecular Weight (g/mol) | 170.25 |
| ChEBI | CHEBI:87327 |
| MDL Number | MFCD00006649 |
| SMILES | CCCCCC1CCCC(=O)O1 |
| Synonym | delta-decalactone,6-pentyltetrahydro-2h-pyran-2-one,5-decanolide,decanolide-1,5,5-decalactone,decan-5-olide,amyl-delta-valerolactone,delta-decanolactone,5-pentyl-5-pentanolide,2h-pyran-2-one, tetrahydro-6-pentyl |
| IUPAC Name | 6-pentyloxan-2-one |
| InChI Key | GHBSPIPJMLAMEP-UHFFFAOYNA-N |
| Molecular Formula | C10H18O2 |
6-Aminonicotinamide, 99%
CAS: 329-89-5 Molecular Formula: C6H7N3O Molecular Weight (g/mol): 137.14 MDL Number: MFCD00006327 InChI Key: ZLWYEPMDOUQDBW-UHFFFAOYSA-N Synonym: 6-aminonicotinamide,2-amino-5-carbamoylpyridine,3-pyridinecarboxamide, 6-amino,6-amino-3-pyridinecarboxamide,6-aminonicotinic acid amide,6-aminonikotinsaeureamid,nicotinamide, 6-amino,aminonicotinamide,6-an,6-amino-nicotinsaeureamid PubChem CID: 9500 ChEBI: CHEBI:74514 IUPAC Name: 6-aminopyridine-3-carboxamide SMILES: NC(=O)C1=CC=C(N)N=C1
| PubChem CID | 9500 |
|---|---|
| CAS | 329-89-5 |
| Molecular Weight (g/mol) | 137.14 |
| ChEBI | CHEBI:74514 |
| MDL Number | MFCD00006327 |
| SMILES | NC(=O)C1=CC=C(N)N=C1 |
| Synonym | 6-aminonicotinamide,2-amino-5-carbamoylpyridine,3-pyridinecarboxamide, 6-amino,6-amino-3-pyridinecarboxamide,6-aminonicotinic acid amide,6-aminonikotinsaeureamid,nicotinamide, 6-amino,aminonicotinamide,6-an,6-amino-nicotinsaeureamid |
| IUPAC Name | 6-aminopyridine-3-carboxamide |
| InChI Key | ZLWYEPMDOUQDBW-UHFFFAOYSA-N |
| Molecular Formula | C6H7N3O |
5-Fluorouracil, ∽99%, MP Biomedicals™
CAS: 51-21-8 Molecular Formula: C4H3FN2O2 Molecular Weight (g/mol): 130.08 MDL Number: MFCD00006018 InChI Key: GHASVSINZRGABV-UHFFFAOYSA-N Synonym: 5-fluorouracil,fluorouracil,5-fu,fluoroplex,adrucil,efudex,carac,fluracil,fluoroblastin,kecimeton PubChem CID: 3385 ChEBI: CHEBI:46345 IUPAC Name: 5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione SMILES: FC1=CNC(=O)NC1=O
| PubChem CID | 3385 |
|---|---|
| CAS | 51-21-8 |
| Molecular Weight (g/mol) | 130.08 |
| ChEBI | CHEBI:46345 |
| MDL Number | MFCD00006018 |
| SMILES | FC1=CNC(=O)NC1=O |
| Synonym | 5-fluorouracil,fluorouracil,5-fu,fluoroplex,adrucil,efudex,carac,fluracil,fluoroblastin,kecimeton |
| IUPAC Name | 5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione |
| InChI Key | GHASVSINZRGABV-UHFFFAOYSA-N |
| Molecular Formula | C4H3FN2O2 |
2-([7-(acetylamino)-6-(benzyloxy)-2-phenylperhydropyrano[3,2-d][1,3]dioxin-8-yl]oxy)propanoic acid, Thermo Scientific™
CAS: 499104-69-7 Molecular Formula: C25H29NO8 Molecular Weight (g/mol): 471.506 InChI Key: JPPMVSNCFXDOJX-UHFFFAOYSA-N Synonym: 2-7-acetylamino-6-benzyloxy-2-phenylperhydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,2r-2-4ar,6s,7r,8r,8as-7-acetamido-6-benzyloxy-2-phenylhexahydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,2-6-benzyloxy-7-acetamido-2-phenyl-hexahydro-2h-pyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,benzyl n-acetyl-4,6-o-benzylidenemuramic acid,2-7-acetamido-6-benzyloxy-2-phenylhexahydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,2-7-acetamido-2-phenyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid PubChem CID: 3843768 IUPAC Name: 2-[(7-acetamido-2-phenyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)oxy]propanoic acid SMILES: CC(C(=O)O)OC1C(C(OC2C1OC(OC2)C3=CC=CC=C3)OCC4=CC=CC=C4)NC(=O)C
| PubChem CID | 3843768 |
|---|---|
| CAS | 499104-69-7 |
| Molecular Weight (g/mol) | 471.506 |
| SMILES | CC(C(=O)O)OC1C(C(OC2C1OC(OC2)C3=CC=CC=C3)OCC4=CC=CC=C4)NC(=O)C |
| Synonym | 2-7-acetylamino-6-benzyloxy-2-phenylperhydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,2r-2-4ar,6s,7r,8r,8as-7-acetamido-6-benzyloxy-2-phenylhexahydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,2-6-benzyloxy-7-acetamido-2-phenyl-hexahydro-2h-pyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,benzyl n-acetyl-4,6-o-benzylidenemuramic acid,2-7-acetamido-6-benzyloxy-2-phenylhexahydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid,2-7-acetamido-2-phenyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano 3,2-d 1,3 dioxin-8-yl oxy propanoic acid |
| IUPAC Name | 2-[(7-acetamido-2-phenyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)oxy]propanoic acid |
| InChI Key | JPPMVSNCFXDOJX-UHFFFAOYSA-N |
| Molecular Formula | C25H29NO8 |
5-Nitro-1H-indazole, 98+%
CAS: 5401-94-5 Molecular Formula: C7H5N3O2 Molecular Weight (g/mol): 163.136 MDL Number: MFCD00005693 InChI Key: WSGURAYTCUVDQL-UHFFFAOYSA-N Synonym: 5-nitroindazole,1h-indazole, 5-nitro,unii-235y7p37zd,ccris 4134,2h-indazole, 5-nitro,5ni,5-nitroindazol,5-nitro indazole,5-nitro-indazole,5-nitro-1h-indazol PubChem CID: 21501 IUPAC Name: 5-nitro-1H-indazole SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C=NN2
| PubChem CID | 21501 |
|---|---|
| CAS | 5401-94-5 |
| Molecular Weight (g/mol) | 163.136 |
| MDL Number | MFCD00005693 |
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C=NN2 |
| Synonym | 5-nitroindazole,1h-indazole, 5-nitro,unii-235y7p37zd,ccris 4134,2h-indazole, 5-nitro,5ni,5-nitroindazol,5-nitro indazole,5-nitro-indazole,5-nitro-1h-indazol |
| IUPAC Name | 5-nitro-1H-indazole |
| InChI Key | WSGURAYTCUVDQL-UHFFFAOYSA-N |
| Molecular Formula | C7H5N3O2 |
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 |