Vestphylline

Modify Date: 2024-02-02 13:29:56

Vestphylline Structure
Vestphylline structure
Common Name Vestphylline
CAS Number 102367-57-7 Molecular Weight 469.57700
Density 1.2g/cm3 Boiling Point 634.2ºC at 760mmHg
Molecular Formula C25H35N5O4 Melting Point N/A
MSDS N/A Flash Point 337.3ºC

 Names

Name [1-[bis(2-methylpropyl)amino]-3-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)propan-2-yl] benzoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2g/cm3
Boiling Point 634.2ºC at 760mmHg
Molecular Formula C25H35N5O4
Molecular Weight 469.57700
Flash Point 337.3ºC
Exact Mass 469.26900
PSA 102.22000
LogP 2.34240
Vapour Pressure 0mmHg at 25°C
Index of Refraction 1.591

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XH5161000
CHEMICAL NAME :
Theophylline-8-ethanol, alpha-((diisobutylamino)methyl)-, benzoate (ester)
CAS REGISTRY NUMBER :
102367-57-7
LAST UPDATED :
199609
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C25-H35-N5-O4
MOLECULAR WEIGHT :
469.65
WISWESSER LINE NOTATION :
T56 BM DN FNVNVJ C1YOVR&1N1Y1&1&1Y1&1 F1 H1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85IPAE "Modern Pharmaceuticals of Japan, III," Tokyo, Japan Pharmaceutical, Medical and Dental Supply Exporters' Assoc., 1968 Volume(issue)/page/year: -,101,1968
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1835 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,306,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
273 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,306,1982

 Synonyms

Diisobutylaminobenzoyloxypropyl theophylline
Vestphyllin
Diisobutylaminobenzoyloxypropyl theophylline (JAN)
7-(3-Diisobutylamino-2-benzoyloxypropyl)theophylline
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