Benzoic acid, 4-((aminoiminomethyl)amino)-, 4-(methylthio)phenyl ester
(4-methylsulfanylphenyl) 4-(diaminomethylideneamino)benzoate
Also Known As: 4-(Methylthio)phenyl 4-((aminoiminomethyl)amino)benzoate|Benzoic acid, 4-((aminoiminomethyl)amino)-, 4-(methylthio)phenyl ester|(4-methylsulfanylphenyl) 4-(diaminomethylideneamino)benzoate|4-(Methylsulfanyl)phenyl 4-[(diaminomethylidene)amino]benzoate
CAS: 79125-85-2
| Molecular Formula | C15H15N3O2S |
|---|---|
| Molecular Weight | 301.0885 g/mol |
| LogP | 2.5326 |
| Topological Polar Surface Area | 90.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.0885 |
| Monoisotopic Mass | 301.0885 |
| Heavy Atoms | 21 |
| Complexity | 647.6239 |
Chemical Identifiers
| CAS Number | 79125-85-2 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N |
Product Overview
Benzoic acid, 4-((aminoiminomethyl)amino)-, 4-(methylthio)phenyl ester (CAS 79125-85-2), with molecular formula C15H15N3O2S and molecular weight 301.0885 g/mol. IUPAC: (4-methylsulfanylphenyl) 4-(diaminomethylideneamino)benzoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Benzoic acid, 4-((aminoiminomethyl)amino)-, 4-(methylthio)phenyl ester is a custom synthesis product. We offer services from milligram to kilogram scale.
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