3,4-Dihydroxypropiophenone

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Names

[ CAS No. ]:
7451-98-1

[ Name ]:
3,4-Dihydroxypropiophenone

[Synonym ]:
MFCD00016440
1-(3,4-dihydroxyphenyl)propan-1-one
1-(3,4-Dihydroxyphenyl)-1-propanone
4-propionylpyrocatechol
Propiophenone,3',4'-dihydroxy
1-Propanone, 1-(3,4-dihydroxyphenyl)-
3',4'-dihydroxypropiophenone
3,4-Dihydroxypropiophenone

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
375.1±27.0 °C at 760 mmHg

[ Melting Point ]:
145-146°C

[ Molecular Formula ]:
C9H10O3

[ Molecular Weight ]:
166.174

[ Flash Point ]:
194.8±20.2 °C

[ Exact Mass ]:
166.062988

[ PSA ]:
57.53000

[ LogP ]:
1.82

[ Vapour Pressure ]:
0.0±0.9 mmHg at 25°C

[ Index of Refraction ]:
1.580

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UH0450000
CHEMICAL NAME :
Propiophenone, 3',4'-dihydroxy-
CAS REGISTRY NUMBER :
7451-98-1
LAST UPDATED :
199203
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C9-H10-O3
MOLECULAR WEIGHT :
166.19
WISWESSER LINE NOTATION :
QR BQ DV2

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 :
760 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 23,990,1989
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

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36/37/39

[ HS Code ]:
2914501900

Synthetic Route

Click to get detail synthetic route

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%

Related Compounds

  • 2-bromo-3-4-dihydroxypropiophenone
  • 3-[(4-chlorophenyl)methyl]-1,3-thiazolidine-2,4-dione
  • 3-(4,4-diphenylpiperidin-1-yl)propyl 3-aminobut-2-enoate
  • 3-[4-(dimethylamino)phenyl]-1,5-diphenylpentane-1,5-dione
  • 3-(4-CHLORO-BENZENESULFONYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
  • 3-(4-methoxyphenyl)prop-1-ynyl-trimethylsilane
  • tert-butyl N-methyl-N-[1-(3-methylpyridin-2-yl)-2-oxoethyl]carbamate
  • Tert-butyl 4-(2-amino-1,1-difluoropropan-2-yl)piperidine-1-carboxylate
  • (1R)-2,2,2-trifluoro-1-(2-fluoro-3-nitrophenyl)ethan-1-ol
  • 2-(4-methylphenyl)-5-[(2R)-oxiran-2-yl]furan
  • 2-[3-Chloro-5-(trifluoromethyl)phenyl]prop-2-en-1-amine
  • 1-(Bromomethyl)-3-phenyl-2-oxabicyclo[2.1.1]hexane
  • 3-Chloro-4-(2-methyloxiran-2-yl)pyridine
  • 4-(3-Chloropyridin-4-yl)-2-methylbutan-2-amine
  • 1-[2-(3-Chloropyridin-4-yl)ethyl]cyclopropan-1-ol
  • 3-(3-Chloropyridin-4-yl)oxolane-2,5-dione
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