1-(3,4-dihydroxyphenyl)butan-1-one
Names
[ CAS No. ]:
17386-89-9
[ Name ]:
1-(3,4-dihydroxyphenyl)butan-1-one
[Synonym ]:
1-(3,4-dihydroxy-phenyl)-butan-1-one
1-(3,4-Dihydroxy-phenyl)-butan-1-on
BUTYROPHENONE,3',4'-DIHYDROXY
1-(3,4-Dihydroxyphenyl)-1-butanone
4-Butyrylpyrocatechol
4-Butyryl-brenzcatechin
3',4'-Dihydroxybutyrophenone
4-Butyroylpyrocatechol
Chemical & Physical Properties
[ Density]:
1.194g/cm3
[ Boiling Point ]:
381.1ºC at 760 mmHg
[ Molecular Formula ]:
C10H12O3
[ Molecular Weight ]:
180.20000
[ Flash Point ]:
198.4ºC
[ Exact Mass ]:
180.07900
[ PSA ]:
57.53000
[ LogP ]:
2.08060
[ Vapour Pressure ]:
2.38E-06mmHg at 25°C
[ Index of Refraction ]:
1.567
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- EU2285000
- CHEMICAL NAME :
- Butyrophenone, 3',4'-dihydroxy-
- CAS REGISTRY NUMBER :
- 17386-89-9
- BEILSTEIN REFERENCE NO. :
- 2255748
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C10-H12-O3
- MOLECULAR WEIGHT :
- 180.22
- WISWESSER LINE NOTATION :
- QR BQ DV3
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 650 mg/kg
- TOXIC EFFECTS :
- Behavioral - altered sleep time (including change in righting reflex)
- 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: 7,178,1964
Safety Information
[ HS Code ]:
2914501900
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2914501900
[ Summary ]:
2914501900 other ketone-phenols。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%