Pyrrolidine,1-[2-[4-[(3R,4S)-3,4-dihydro-7-methoxy-2,2-dimethyl-3-phenyl-2H-1-benzopyran-4-yl]phenoxy]ethyl]-,rel-

Modify Date: 2024-03-02 12:27:06

Pyrrolidine,1-[2-[4-[(3R,4S)-3,4-dihydro-7-methoxy-2,2-dimethyl-3-phenyl-2H-1-benzopyran-4-yl]phenoxy]ethyl]-,rel- Structure
Pyrrolidine,1-[2-[4-[(3R,4S)-3,4-dihydro-7-methoxy-2,2-dimethyl-3-phenyl-2H-1-benzopyran-4-yl]phenoxy]ethyl]-,rel- structure
Common Name Pyrrolidine,1-[2-[4-[(3R,4S)-3,4-dihydro-7-methoxy-2,2-dimethyl-3-phenyl-2H-1-benzopyran-4-yl]phenoxy]ethyl]-,rel-
CAS Number 51423-20-2 Molecular Weight 457.60400
Density 1.104g/cm3 Boiling Point 556.3ºC at 760 mmHg
Molecular Formula C30H35NO3 Melting Point N/A
MSDS N/A Flash Point 145.6ºC

 Names

Name 1-[2-[4-(7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydrochromen-4-yl)phenoxy]ethyl]pyrrolidine

 Chemical & Physical Properties

Density 1.104g/cm3
Boiling Point 556.3ºC at 760 mmHg
Molecular Formula C30H35NO3
Molecular Weight 457.60400
Flash Point 145.6ºC
Exact Mass 457.26200
PSA 30.93000
LogP 6.19440
Index of Refraction 1.571

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UY0876400
CHEMICAL NAME :
Pyrrolidine, 1-(2-(4-(3,4-dihydro-7-methoxy-2,2-dimethyl-3-phenyl- 2H-1-benzopyran-4-yl) phenoxy)ethyl)-, cis-
CAS REGISTRY NUMBER :
51423-20-2
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C30-H35-N-O3
MOLECULAR WEIGHT :
457.66

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 :
2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
IJSIDW Indian Journal of Pharmaceutical Sciences. (Kalina, Santa Cruz (East), Bombay 400 029, India) V.40(2)- 1978- Volume(issue)/page/year: 49,43,1987 ** REPRODUCTIVE DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
350 mg/kg
SEX/DURATION :
female 1-7 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - pre-implantation mortality (e.g. reduction in number of implants per female; total number of implants per corpora lutea)
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 26,592,1983

 Safety Information

HS Code 2934999090

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%