benzyl 2-[4-[(diaminomethylideneamino)methyl]cyclohexanecarbonyl]oxybenzoate
Names
[ CAS No. ]:
78718-52-2
[ Name ]:
benzyl 2-[4-[(diaminomethylideneamino)methyl]cyclohexanecarbonyl]oxybenzoate
[Synonym ]:
Benexato [Spanish]
Benexato
Benexatum [Latin]
benzyl 2-{[(4-{[(diaminomethylidene)amino]methyl}cyclohexyl)carbonyl]oxy}benzoate
Benzyl 2-((trans-4-(guanidinomethyl)cyclohexanecarbonyl)oxy)benzoate
Benexate
Benexate (INN)
Benzoic acid,2-(((4-(((aminoiminomethyl)amino)methyl)cyclohexyl)carbonyl)oxy)-,phenylmethyl ester,trans
Chemical & Physical Properties
[ Density]:
1.26g/cm3
[ Boiling Point ]:
582.7ºC at 760 mmHg
[ Molecular Formula ]:
C23H27N3O4
[ Molecular Weight ]:
409.47800
[ Flash Point ]:
306.2ºC
[ Exact Mass ]:
409.20000
[ PSA ]:
114.50000
[ LogP ]:
4.42940
[ Index of Refraction ]:
1.612
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DG2800660
- CHEMICAL NAME :
- Benzoic acid, 2-(((4-(((aminoiminomethyl)amino)methyl)cyclohexyl)ca rbonyl)oxy)-, phenylmethyl ester, trans-
- CAS REGISTRY NUMBER :
- 78718-52-2
- LAST UPDATED :
- 199303
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C23-H27-N3-O4
- MOLECULAR WEIGHT :
- 409.53
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 8010 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JKXXAF Japanese Kokai Tokyo Koho Patents. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #91-90017
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 7600 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JKXXAF Japanese Kokai Tokyo Koho Patents. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #91-90017
Safety Information
[ HS Code ]:
2925290090
Customs
[ HS Code ]: 2925290090
[ Summary ]:
2925290090 other imines and their derivatives; salts thereof。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%