Organoheterocyclic compounds
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2,3-Diamino-6-chloropyridine, 95%
CAS: 40851-95-4 Molecular Formula: C5H6ClN3 Molecular Weight (g/mol): 143.57 MDL Number: MFCD00209966 InChI Key: QEIRYIILFUVXAM-UHFFFAOYSA-N Synonym: 2,3-diamino-6-chloropyridine,6-chloro-2,3-diaminopyridine,2,3-pyridinediamine,6-chloro,2,3-pyridinediamine, 6-chloro,6-chloro-pyridine-2,3-diamine,6-chloro-2,3-pyridinediamine,pubchem19958,6-chloro 2,3-pyridindiamine,2,3-diamino-6-chloro-pyridine PubChem CID: 10630615 IUPAC Name: 6-chloropyridine-2,3-diamine SMILES: NC1=C(N)N=C(Cl)C=C1
| PubChem CID | 10630615 |
|---|---|
| CAS | 40851-95-4 |
| Molecular Weight (g/mol) | 143.57 |
| MDL Number | MFCD00209966 |
| SMILES | NC1=C(N)N=C(Cl)C=C1 |
| Synonym | 2,3-diamino-6-chloropyridine,6-chloro-2,3-diaminopyridine,2,3-pyridinediamine,6-chloro,2,3-pyridinediamine, 6-chloro,6-chloro-pyridine-2,3-diamine,6-chloro-2,3-pyridinediamine,pubchem19958,6-chloro 2,3-pyridindiamine,2,3-diamino-6-chloro-pyridine |
| IUPAC Name | 6-chloropyridine-2,3-diamine |
| InChI Key | QEIRYIILFUVXAM-UHFFFAOYSA-N |
| Molecular Formula | C5H6ClN3 |
3-Cyano-4-methoxy-2-pyridone, 95%, Thermo Scientific Chemicals
CAS: 21642-98-8 Molecular Formula: C7H6N2O2 Molecular Weight (g/mol): 150.14 MDL Number: MFCD00975442 InChI Key: MWGIDWPSRDMIQN-UHFFFAOYSA-N Synonym: 4-methoxy-2-oxo-1,2-dihydropyridine-3-carbonitrile,4-methoxy-2-oxo-1,2-dihydro-pyridine-3-carbonitrile,3-cyano-2-hydroxy-4-methoxypyridine,4-methoxy-2-oxo-1,2-dihydro-3-pyridinecarbonitrile,2-hydroxy-4-methoxynicotinonitrile,1,2-dihydro-4-methoxy-2-oxo-3-pyridinecarbonitrile,3-pyridinecarbonitrile, 1,2-dihydro-4-methoxy-2-oxo,3-cyano-4-methoxy-2 1h-pyridinone,2-hydroxy-4-methoxy-nicotinonitrile,3-cyano-4-methoxy-2-1h-pyridinone PubChem CID: 2786702 SMILES: COC1=C(C#N)C(=O)NC=C1
| PubChem CID | 2786702 |
|---|---|
| CAS | 21642-98-8 |
| Molecular Weight (g/mol) | 150.14 |
| MDL Number | MFCD00975442 |
| SMILES | COC1=C(C#N)C(=O)NC=C1 |
| Synonym | 4-methoxy-2-oxo-1,2-dihydropyridine-3-carbonitrile,4-methoxy-2-oxo-1,2-dihydro-pyridine-3-carbonitrile,3-cyano-2-hydroxy-4-methoxypyridine,4-methoxy-2-oxo-1,2-dihydro-3-pyridinecarbonitrile,2-hydroxy-4-methoxynicotinonitrile,1,2-dihydro-4-methoxy-2-oxo-3-pyridinecarbonitrile,3-pyridinecarbonitrile, 1,2-dihydro-4-methoxy-2-oxo,3-cyano-4-methoxy-2 1h-pyridinone,2-hydroxy-4-methoxy-nicotinonitrile,3-cyano-4-methoxy-2-1h-pyridinone |
| InChI Key | MWGIDWPSRDMIQN-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2O2 |
2-Cyano-6-methylpyridine, 98%
CAS: 1620-75-3 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.14 MDL Number: MFCD00190586 InChI Key: CMADFEQMYFNYCF-UHFFFAOYSA-N Synonym: 6-methylpicolinonitrile,2-cyano-6-methylpyridine,6-methyl-2-pyridinecarbonitrile,2-methyl-6-cyanopyridine,6-methyl-pyridine-2-carbonitrile,2-pyridinecarbonitrile, 6-methyl,6-methyl-2-cyanopyridine,2-cyano-6-methyl pyridine,2-cyano-6-methylpyridine 2-cyano-6-picoline,6-methylpyridin-2-carbonitril PubChem CID: 74182 IUPAC Name: 6-methylpyridine-2-carbonitrile SMILES: CC1=CC=CC(=N1)C#N
| PubChem CID | 74182 |
|---|---|
| CAS | 1620-75-3 |
| Molecular Weight (g/mol) | 118.14 |
| MDL Number | MFCD00190586 |
| SMILES | CC1=CC=CC(=N1)C#N |
| Synonym | 6-methylpicolinonitrile,2-cyano-6-methylpyridine,6-methyl-2-pyridinecarbonitrile,2-methyl-6-cyanopyridine,6-methyl-pyridine-2-carbonitrile,2-pyridinecarbonitrile, 6-methyl,6-methyl-2-cyanopyridine,2-cyano-6-methyl pyridine,2-cyano-6-methylpyridine 2-cyano-6-picoline,6-methylpyridin-2-carbonitril |
| IUPAC Name | 6-methylpyridine-2-carbonitrile |
| InChI Key | CMADFEQMYFNYCF-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2 |
2-Fluoro-5-nitropyridine, 98%
CAS: 456-24-6 Molecular Formula: C5H3FN2O2 Molecular Weight (g/mol): 142.089 MDL Number: MFCD03095059 InChI Key: XOZAJNLUAODXSP-UHFFFAOYSA-N Synonym: 6-fluoro-3-nitropyridine,pyridine, 2-fluoro-5-nitro,2-fluor-5-nitropyridin,2-fluoro-5-nitro-pyridine,abbypharma ap-15-5253,pubchem1202,acmc-1arnr,5-nitro-2-fluoropyridine,2-fluoro-5-nitro pyridine PubChem CID: 95264 IUPAC Name: 2-fluoro-5-nitropyridine SMILES: C1=CC(=NC=C1[N+](=O)[O-])F
| PubChem CID | 95264 |
|---|---|
| CAS | 456-24-6 |
| Molecular Weight (g/mol) | 142.089 |
| MDL Number | MFCD03095059 |
| SMILES | C1=CC(=NC=C1[N+](=O)[O-])F |
| Synonym | 6-fluoro-3-nitropyridine,pyridine, 2-fluoro-5-nitro,2-fluor-5-nitropyridin,2-fluoro-5-nitro-pyridine,abbypharma ap-15-5253,pubchem1202,acmc-1arnr,5-nitro-2-fluoropyridine,2-fluoro-5-nitro pyridine |
| IUPAC Name | 2-fluoro-5-nitropyridine |
| InChI Key | XOZAJNLUAODXSP-UHFFFAOYSA-N |
| Molecular Formula | C5H3FN2O2 |
2-Bromo-5-cyanopyridine, 97%
CAS: 139585-70-9 Molecular Formula: C6H3BrN2 Molecular Weight (g/mol): 183.008 MDL Number: MFCD00234141 InChI Key: XHYGUDGTUJPSNX-UHFFFAOYSA-N Synonym: 2-bromo-5-cyanopyridine,6-bromonicotinonitrile,2-bromo-5-pyridinecarbonitrile,5-cyano-2-bromopyridine,6-bromo-nicotinonitrile,6-bromo-3-pyridinecarbonitrile,3-pyridinecarbonitrile, 6-bromo,pubchem5963,2-bromo-5-cyano-pyridine,acmc-209cj9 PubChem CID: 5005718 IUPAC Name: 6-bromopyridine-3-carbonitrile SMILES: C1=CC(=NC=C1C#N)Br
| PubChem CID | 5005718 |
|---|---|
| CAS | 139585-70-9 |
| Molecular Weight (g/mol) | 183.008 |
| MDL Number | MFCD00234141 |
| SMILES | C1=CC(=NC=C1C#N)Br |
| Synonym | 2-bromo-5-cyanopyridine,6-bromonicotinonitrile,2-bromo-5-pyridinecarbonitrile,5-cyano-2-bromopyridine,6-bromo-nicotinonitrile,6-bromo-3-pyridinecarbonitrile,3-pyridinecarbonitrile, 6-bromo,pubchem5963,2-bromo-5-cyano-pyridine,acmc-209cj9 |
| IUPAC Name | 6-bromopyridine-3-carbonitrile |
| InChI Key | XHYGUDGTUJPSNX-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrN2 |
3-Amino-2-chloro-5-(trifluoromethyl)pyridine, 98%
CAS: 72587-18-9 Molecular Formula: C6H4ClF3N2 Molecular Weight (g/mol): 196.557 MDL Number: MFCD07375383 InChI Key: HABKYPVMMHBOIW-UHFFFAOYSA-N Synonym: 2-chloro-5-trifluoromethyl pyridin-3-amine,2-chloro-5-trifluoromethyl-3-pyridinamine,3-amino-2-chloro-5-trifluoromethyl pyridine,3-amino-2-chloro-5-trifluoromethylpyridine,2-chloro-3-amino-5-trifluoromethyl pyridine PubChem CID: 12919757 IUPAC Name: 2-chloro-5-(trifluoromethyl)pyridin-3-amine SMILES: C1=C(C=NC(=C1N)Cl)C(F)(F)F
| PubChem CID | 12919757 |
|---|---|
| CAS | 72587-18-9 |
| Molecular Weight (g/mol) | 196.557 |
| MDL Number | MFCD07375383 |
| SMILES | C1=C(C=NC(=C1N)Cl)C(F)(F)F |
| Synonym | 2-chloro-5-trifluoromethyl pyridin-3-amine,2-chloro-5-trifluoromethyl-3-pyridinamine,3-amino-2-chloro-5-trifluoromethyl pyridine,3-amino-2-chloro-5-trifluoromethylpyridine,2-chloro-3-amino-5-trifluoromethyl pyridine |
| IUPAC Name | 2-chloro-5-(trifluoromethyl)pyridin-3-amine |
| InChI Key | HABKYPVMMHBOIW-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClF3N2 |
5-Amino-2-bromo-3-methylpyridine, 98%
CAS: 38186-83-3 Molecular Formula: C6H7BrN2 Molecular Weight (g/mol): 187.04 MDL Number: MFCD03095085 InChI Key: IEONGQZSAUAAKH-UHFFFAOYSA-N Synonym: 5-amino-2-bromo-3-picoline,5-amino-2-bromo-3-methylpyridine,3-pyridinamine, 6-bromo-5-methyl,6-bromo-5-methyl-3-pyridylamine,6-bromo-5-methyl-3-aminopyridine,pubchem1129,ksc985c1p,2-bromo-3-methyl-5-aminopyridine,2-bromo-5-amino-3-methylpyridine,6-bromo-5-methyl-pyridin-3-ylamine PubChem CID: 12362446 IUPAC Name: 6-bromo-5-methylpyridin-3-amine SMILES: CC1=CC(N)=CN=C1Br
| PubChem CID | 12362446 |
|---|---|
| CAS | 38186-83-3 |
| Molecular Weight (g/mol) | 187.04 |
| MDL Number | MFCD03095085 |
| SMILES | CC1=CC(N)=CN=C1Br |
| Synonym | 5-amino-2-bromo-3-picoline,5-amino-2-bromo-3-methylpyridine,3-pyridinamine, 6-bromo-5-methyl,6-bromo-5-methyl-3-pyridylamine,6-bromo-5-methyl-3-aminopyridine,pubchem1129,ksc985c1p,2-bromo-3-methyl-5-aminopyridine,2-bromo-5-amino-3-methylpyridine,6-bromo-5-methyl-pyridin-3-ylamine |
| IUPAC Name | 6-bromo-5-methylpyridin-3-amine |
| InChI Key | IEONGQZSAUAAKH-UHFFFAOYSA-N |
| Molecular Formula | C6H7BrN2 |
5,7-Dichlorokynurenic acid
CAS: 190908-40-8 Molecular Formula: C10H7Cl2NO4 Molecular Weight (g/mol): 276.069 MDL Number: MFCD11045951 InChI Key: READYYZXDSXRQJ-UHFFFAOYSA-N Synonym: 5,7-dichlorokynurenic acid monohydrate,dcka hydrate,c10h5cl2no3 hydrate,5,7-dichloro-4-hydroxyquinoline-2-carboxylic acid monohydrate,5,7-dichlorokynurenic acid monohydrate, solid hplc,2-quinolinecarboxylic acid, 5,7-dichloro-4-hydroxy-, monohydrate,2-quinolinecarboxylicacid, 5,7-dichloro-4-hydroxy-, hydrate 1:1,5,7-dichloro-4-oxo-1,4-dihydroquinoline-2-carboxylic acid-water 1/1 PubChem CID: 23723057 IUPAC Name: 5,7-dichloro-4-oxo-1H-quinoline-2-carboxylic acid;hydrate SMILES: C1=C(C=C2C(=C1Cl)C(=O)C=C(N2)C(=O)O)Cl.O
| PubChem CID | 23723057 |
|---|---|
| CAS | 190908-40-8 |
| Molecular Weight (g/mol) | 276.069 |
| MDL Number | MFCD11045951 |
| SMILES | C1=C(C=C2C(=C1Cl)C(=O)C=C(N2)C(=O)O)Cl.O |
| Synonym | 5,7-dichlorokynurenic acid monohydrate,dcka hydrate,c10h5cl2no3 hydrate,5,7-dichloro-4-hydroxyquinoline-2-carboxylic acid monohydrate,5,7-dichlorokynurenic acid monohydrate, solid hplc,2-quinolinecarboxylic acid, 5,7-dichloro-4-hydroxy-, monohydrate,2-quinolinecarboxylicacid, 5,7-dichloro-4-hydroxy-, hydrate 1:1,5,7-dichloro-4-oxo-1,4-dihydroquinoline-2-carboxylic acid-water 1/1 |
| IUPAC Name | 5,7-dichloro-4-oxo-1H-quinoline-2-carboxylic acid;hydrate |
| InChI Key | READYYZXDSXRQJ-UHFFFAOYSA-N |
| Molecular Formula | C10H7Cl2NO4 |
2,3-Dichloropyridine-4-carboxylic acid, 97%, Thermo Scientific Chemicals
CAS: 184416-84-0 Molecular Formula: C6H3Cl2NO2 Molecular Weight (g/mol): 192.00 MDL Number: MFCD01861977 InChI Key: VGKZZKKTZKRCPA-UHFFFAOYSA-N Synonym: 2,3-dichloroisonicotinic acid,dichloroisonicotinic acid,4-carboxy-2,3-dichloropyridine,2,3-dichloro-4-pyridinecarboxylic acid,2,3-dichloropyridine-4-carboxylicacid,2,3-dichloro pyridine-4-carboxylic acid,pubchem22306,acmc-1cbyj,2,3-dichloroisonicotinicacid,2,3-dichloro-isonicotinic acid PubChem CID: 2736083 IUPAC Name: 2,3-dichloropyridine-4-carboxylic acid SMILES: OC(=O)C1=C(Cl)C(Cl)=NC=C1
| PubChem CID | 2736083 |
|---|---|
| CAS | 184416-84-0 |
| Molecular Weight (g/mol) | 192.00 |
| MDL Number | MFCD01861977 |
| SMILES | OC(=O)C1=C(Cl)C(Cl)=NC=C1 |
| Synonym | 2,3-dichloroisonicotinic acid,dichloroisonicotinic acid,4-carboxy-2,3-dichloropyridine,2,3-dichloro-4-pyridinecarboxylic acid,2,3-dichloropyridine-4-carboxylicacid,2,3-dichloro pyridine-4-carboxylic acid,pubchem22306,acmc-1cbyj,2,3-dichloroisonicotinicacid,2,3-dichloro-isonicotinic acid |
| IUPAC Name | 2,3-dichloropyridine-4-carboxylic acid |
| InChI Key | VGKZZKKTZKRCPA-UHFFFAOYSA-N |
| Molecular Formula | C6H3Cl2NO2 |
3-Amino-6-chloro-5-methoxypyridine, 97%, Thermo Scientific Chemicals
CAS: 75711-01-2 Molecular Formula: C6H7ClN2O Molecular Weight (g/mol): 158.59 MDL Number: MFCD09952112 InChI Key: FJKVNEBFHWMVGF-UHFFFAOYSA-N Synonym: 3-amino-6-chloro-5-methoxy pyridine,3-amino-6-chloro-5-methoxypyridine,5-amino-2-chloro-3-methoxypyridine,3-pyridinamine, 6-chloro-5-methoxy,pubchem22114,6-chloro-5-methoxypyridine-3-amine,6-chloro-5-methyloxy-3-pyridinamine PubChem CID: 23456143 IUPAC Name: 6-chloro-5-methoxypyridin-3-amine SMILES: COC1=C(Cl)N=CC(N)=C1
| PubChem CID | 23456143 |
|---|---|
| CAS | 75711-01-2 |
| Molecular Weight (g/mol) | 158.59 |
| MDL Number | MFCD09952112 |
| SMILES | COC1=C(Cl)N=CC(N)=C1 |
| Synonym | 3-amino-6-chloro-5-methoxy pyridine,3-amino-6-chloro-5-methoxypyridine,5-amino-2-chloro-3-methoxypyridine,3-pyridinamine, 6-chloro-5-methoxy,pubchem22114,6-chloro-5-methoxypyridine-3-amine,6-chloro-5-methyloxy-3-pyridinamine |
| IUPAC Name | 6-chloro-5-methoxypyridin-3-amine |
| InChI Key | FJKVNEBFHWMVGF-UHFFFAOYSA-N |
| Molecular Formula | C6H7ClN2O |
2-Mercaptothiazoline, 98+%
CAS: 96-53-7 Molecular Formula: C3H5NS2 Molecular Weight (g/mol): 119.2 MDL Number: MFCD00126013 InChI Key: WGJCBBASTRWVJL-UHFFFAOYSA-N Synonym: 2-mercaptothiazoline,2-thiazolidinethione,2-thiazoline-2-thiol,thiazolidine-2-thione,metabasal,thyroidan,2-mercapto-2-thiazoline,mercaptothiazoline,2-thiothiazolidone,2-thiazolidenethione PubChem CID: 2723699 IUPAC Name: 1,3-thiazolidine-2-thione SMILES: C1CSC(=S)N1
| PubChem CID | 2723699 |
|---|---|
| CAS | 96-53-7 |
| Molecular Weight (g/mol) | 119.2 |
| MDL Number | MFCD00126013 |
| SMILES | C1CSC(=S)N1 |
| Synonym | 2-mercaptothiazoline,2-thiazolidinethione,2-thiazoline-2-thiol,thiazolidine-2-thione,metabasal,thyroidan,2-mercapto-2-thiazoline,mercaptothiazoline,2-thiothiazolidone,2-thiazolidenethione |
| IUPAC Name | 1,3-thiazolidine-2-thione |
| InChI Key | WGJCBBASTRWVJL-UHFFFAOYSA-N |
| Molecular Formula | C3H5NS2 |
7-Chlorokynurenic acid, 98+%
CAS: 18000-24-3 Molecular Formula: C10H6ClNO3 Molecular Weight (g/mol): 223.61 MDL Number: MFCD00069227 InChI Key: UAWVRVFHMOSAPU-UHFFFAOYSA-N Synonym: 7-chlorokynurenic acid,7-chloro-4-hydroxyquinoline-2-carboxylic acid,7-cl-kyna,7-chloro-kynurenic acid,unii-s7936qon2k,7-chloro-4-hydroxy-2-carboxyquinoline,7-cka,7-chloro-4-hydroxy-2-quinolinecarboxylic acid,2-quinolinecarboxylic acid, 7-chloro-1,4-dihydro-4-oxo,cka PubChem CID: 1884 ChEBI: CHEBI:63965 IUPAC Name: 7-chloro-4-oxo-1,4-dihydroquinoline-2-carboxylic acid SMILES: OC(=O)C1=CC(=O)C2=CC=C(Cl)C=C2N1
| PubChem CID | 1884 |
|---|---|
| CAS | 18000-24-3 |
| Molecular Weight (g/mol) | 223.61 |
| ChEBI | CHEBI:63965 |
| MDL Number | MFCD00069227 |
| SMILES | OC(=O)C1=CC(=O)C2=CC=C(Cl)C=C2N1 |
| Synonym | 7-chlorokynurenic acid,7-chloro-4-hydroxyquinoline-2-carboxylic acid,7-cl-kyna,7-chloro-kynurenic acid,unii-s7936qon2k,7-chloro-4-hydroxy-2-carboxyquinoline,7-cka,7-chloro-4-hydroxy-2-quinolinecarboxylic acid,2-quinolinecarboxylic acid, 7-chloro-1,4-dihydro-4-oxo,cka |
| IUPAC Name | 7-chloro-4-oxo-1,4-dihydroquinoline-2-carboxylic acid |
| InChI Key | UAWVRVFHMOSAPU-UHFFFAOYSA-N |
| Molecular Formula | C10H6ClNO3 |
1-(2,3-Epoxypropyl)-2-nitroimidazole, 97%
CAS: 13551-90-1 Molecular Formula: C6H7N3O3 Molecular Weight (g/mol): 169.14 MDL Number: MFCD20527194 InChI Key: SYFMSLVOHQZYEB-UHFFFAOYSA-N Synonym: 1-2,3-epoxypropyl-2-nitroimidazole,2-nitro-1-oxiran-2-ylmethyl imidazole,2-nitro-1-oxiran-2-ylmethyl-1h-imidazole,1-glycidyl-2-nitro-1h-imidazole,1-oxiranylmethyl-2-nitroimidazole,2-nitro-1-oxiranylmethyl-1h-imidazole,1-oxiranylmethyl-2-nitro-1h-imidazole PubChem CID: 334973 IUPAC Name: 2-nitro-1-(oxiran-2-ylmethyl)imidazole SMILES: C1C(O1)CN2C=CN=C2[N+](=O)[O-]
| PubChem CID | 334973 |
|---|---|
| CAS | 13551-90-1 |
| Molecular Weight (g/mol) | 169.14 |
| MDL Number | MFCD20527194 |
| SMILES | C1C(O1)CN2C=CN=C2[N+](=O)[O-] |
| Synonym | 1-2,3-epoxypropyl-2-nitroimidazole,2-nitro-1-oxiran-2-ylmethyl imidazole,2-nitro-1-oxiran-2-ylmethyl-1h-imidazole,1-glycidyl-2-nitro-1h-imidazole,1-oxiranylmethyl-2-nitroimidazole,2-nitro-1-oxiranylmethyl-1h-imidazole,1-oxiranylmethyl-2-nitro-1h-imidazole |
| IUPAC Name | 2-nitro-1-(oxiran-2-ylmethyl)imidazole |
| InChI Key | SYFMSLVOHQZYEB-UHFFFAOYSA-N |
| Molecular Formula | C6H7N3O3 |
Brucine
CAS: 357-57-3 Molecular Formula: C23H26N2O4 Molecular Weight (g/mol): 394.471 MDL Number: MFCD00005942 InChI Key: RRKTZKIUPZVBMF-VLTSECPOSA-N Synonym: brucine, anhydrous,brucine:strychnidin-10-one,2,3-dimethoxy PubChem CID: 51413923 IUPAC Name: (4aR,5aS,8aR,13aS,15aR,15bS)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one SMILES: COC1=C(C=C2C(=C1)C34CCN5C3CC6C7C4N2C(=O)CC7OCC=C6C5)OC
| PubChem CID | 51413923 |
|---|---|
| CAS | 357-57-3 |
| Molecular Weight (g/mol) | 394.471 |
| MDL Number | MFCD00005942 |
| SMILES | COC1=C(C=C2C(=C1)C34CCN5C3CC6C7C4N2C(=O)CC7OCC=C6C5)OC |
| Synonym | brucine, anhydrous,brucine:strychnidin-10-one,2,3-dimethoxy |
| IUPAC Name | (4aR,5aS,8aR,13aS,15aR,15bS)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one |
| InChI Key | RRKTZKIUPZVBMF-VLTSECPOSA-N |
| Molecular Formula | C23H26N2O4 |
5-Carboxyfluorescein, single isomer, 97%
CAS: 76823-03-5 Molecular Formula: C21H12O7 Molecular Weight (g/mol): 376.32 MDL Number: MFCD00036874 InChI Key: NJYVEMPWNAYQQN-UHFFFAOYSA-N Synonym: 5-carboxyfluorescein,5-fam,4-carboxyfluorescein,4 5-carboxyfluorescein,3',6'-dihydroxy-3-oxo-3h-spiro isobenzofuran-1,9'-xanthene-5-carboxylic acid,3',6'-dihydroxy-3-oxo-3h-spiro 2-benzofuran-1,9'-xanthene-5-carboxylic acid,3',6'-dihydroxy-3-oxospiro 2-benzofuran-1,9'-xanthene-5-carboxylic acid,spiro isobenzofuran-1 3h ,9'-9h xanthene-5-carboxylic acid, 3',6-dihydroxy-3-oxo,bidd:gt0758,5-carboxy fluorescein; 5-fam PubChem CID: 123755 ChEBI: CHEBI:51617 IUPAC Name: 3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-5-carboxylic acid SMILES: OC(=O)C1=CC=C2C(=C1)C(=O)OC21C2=CC=C(O)C=C2OC2=CC(O)=CC=C12
| PubChem CID | 123755 |
|---|---|
| CAS | 76823-03-5 |
| Molecular Weight (g/mol) | 376.32 |
| ChEBI | CHEBI:51617 |
| MDL Number | MFCD00036874 |
| SMILES | OC(=O)C1=CC=C2C(=C1)C(=O)OC21C2=CC=C(O)C=C2OC2=CC(O)=CC=C12 |
| Synonym | 5-carboxyfluorescein,5-fam,4-carboxyfluorescein,4 5-carboxyfluorescein,3',6'-dihydroxy-3-oxo-3h-spiro isobenzofuran-1,9'-xanthene-5-carboxylic acid,3',6'-dihydroxy-3-oxo-3h-spiro 2-benzofuran-1,9'-xanthene-5-carboxylic acid,3',6'-dihydroxy-3-oxospiro 2-benzofuran-1,9'-xanthene-5-carboxylic acid,spiro isobenzofuran-1 3h ,9'-9h xanthene-5-carboxylic acid, 3',6-dihydroxy-3-oxo,bidd:gt0758,5-carboxy fluorescein; 5-fam |
| IUPAC Name | 3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-5-carboxylic acid |
| InChI Key | NJYVEMPWNAYQQN-UHFFFAOYSA-N |
| Molecular Formula | C21H12O7 |