4-(Benzothiazol-2-ylsulfanyl)-3-nitro-benzoic acid
4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitrobenzoic acid
Also Known As: 4-(Benzothiazol-2-ylsulfanyl)-3-nitro-benzoic acid|4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitrobenzoic acid|4-(Benzo[d]thiazol-2-ylthio)-3-nitrobenzoic acid|4-benzothiazol-2-ylthio-3-nitrobenzoic acid|4-(Benzo[d]thiazol-2-ylthio)-3-nitrobenzoicacid|4-benzothiazol-2-ylsulfanyl-3-nitro-benzoic Acid|benzoic acid, 4-(2-benzothiazolylthio)-3-nitro-|4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitro-benzoic acid
| Molecular Formula | C14H8N2O4S2 |
|---|---|
| Molecular Weight | 331.99255 g/mol |
| LogP | 4.0539 |
| Topological Polar Surface Area | 93.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 331.99255 |
| Monoisotopic Mass | 331.99255 |
| Heavy Atoms | 22 |
| Complexity | 858.4352 |
Chemical Identifiers
| CAS Number | 346597-52-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)SC3=C(C=C(C=C3)C(=O)O)[N+](=O)[O-] |
Product Overview
4-(Benzothiazol-2-ylsulfanyl)-3-nitro-benzoic acid (CAS 346597-52-2), with molecular formula C14H8N2O4S2 and molecular weight 331.99255 g/mol. IUPAC: 4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitrobenzoic acid.
4-(Benzothiazol-2-ylsulfanyl)-3-nitro-benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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