2-[4-[(3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydrochromen-4-yl]phenoxy]ethanamine
Names
[ CAS No. ]:
123886-71-5
[ Name ]:
2-[4-[(3S,4S)-7-methoxy-2,2-dimethyl-3-phenyl-3,4-dihydrochromen-4-yl]phenoxy]ethanamine
[Synonym ]:
Ethanamine,2-(4-(3,4-dihydro-7-methoxy-2,2-dimethyl-3-phenyl-2H-1-benzopyran-4-yl)phenoxy)-,hydrochloride,trans
Chemical & Physical Properties
[ Density]:
1.113g/cm3
[ Boiling Point ]:
514.6ºC at 760mmHg
[ Molecular Formula ]:
C26H29NO3
[ Molecular Weight ]:
403.51300
[ Flash Point ]:
264.5ºC
[ Exact Mass ]:
403.21500
[ PSA ]:
53.71000
[ LogP ]:
5.81970
[ Vapour Pressure ]:
1.07E-10mmHg at 25°C
[ Index of Refraction ]:
1.575
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- KH2347500
- CHEMICAL NAME :
- Ethanamine, 2-(4-(3,4-dihydro-7-methoxy-2,2-dimethyl-3-phenyl-2H- 1-benzopyran-4-yl)phe noxy)-, hydrochloride, trans-
- CAS REGISTRY NUMBER :
- 123886-71-5
- LAST UPDATED :
- 199112
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C26-H29-N-O3.Cl-H
- MOLECULAR WEIGHT :
- 440.02
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 :
- 500 mg/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: 51,48,1989
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 500 mg/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: 51,48,1989