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Substance Name: Benzoic acid, 4-((aminoiminomethyl)amino)-, phenyl ester, phosphate (1:1)
RN: 111941-80-1
InChIKey: GSPSGKATNZWKDP-UHFFFAOYSA-N
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C14-H13-N3-O2.H3-O4-P
Molecular Weight
- 353.2694
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Names and Synonyms
Synonym
- Phenyl 4-((aminoiminomethyl)amino)benzoate phosphate (1:1)
Systematic Name
- Benzoic acid, 4-((aminoiminomethyl)amino)-, phenyl ester, phosphate (1:1)
Registry Numbers
CAS Registry Number
- 111941-80-1
System Generated Number
- 0111941801
Molecular Formulas
Molecular Formula
- C14-H13-N3-O2.H3-O4-P
Molecular Formula Fragments
- C14-H13-N3-O2
- COMPONENT
- H3-O4-P
Structure Descriptors
InChI
1S/C14H13N3O2.H3O4P/c15-14(16)17-11-8-6-10(7-9-11)13(18)19-12-4-2-1-3-5-12;1-5(2,3)4/h1-9H,(H4,15,16,17);(H3,1,2,3,4)InChIKey
GSPSGKATNZWKDP-UHFFFAOYSA-NSmiles
c1ccc(cc1)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 50mg/kg (50mg/kg) | United States Patent Document. Vol. #4975464, |