Benzoic acid, 3-[2-[(aminoiminomethyl)amino]ethyl]-
3-[2-(diaminomethylideneamino)ethyl]benzoic acid
Also Known As: 3-(2-guanidinoethyl)benzoic acid|Benzoic acid, 3-[2-[(aminoiminomethyl)amino]ethyl]-|3-[2-(diaminomethylideneamino)ethyl]benzoic acid
CAS: 199535-06-3
| Molecular Formula | C10H13N3O2 |
|---|---|
| Molecular Weight | 207.10077 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.10077 |
| Monoisotopic Mass | 207.10077 |
| Heavy Atoms | 15 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 199535-06-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)O)CCN=C(N)N |
| InChIKey | QUYICSLJBMAOBK-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 3-[2-[(aminoiminomethyl)amino]ethyl]- (CAS 199535-06-3), with molecular formula C10H13N3O2 and molecular weight 207.10077 g/mol. IUPAC: 3-[2-(diaminomethylideneamino)ethyl]benzoic acid.
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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