1-(4-Hydroxyphenyl)propan-1-one

Suppliers

Names

[ CAS No. ]:
70-70-2

[ Name ]:
1-(4-Hydroxyphenyl)propan-1-one

[Synonym ]:
4'-hydroxy-propiophenone
H-365
EINECS 202-815-9
paroxypropione
p-Hydroxypropiophenone
1-Propanone, 1-(4-hydroxyphenyl)-
4-Hydroxypropiophenone
Mepal
POP
para-hydroxy-propiophenone
1-(4-hydroxyphenyl)propan-1-one
MFCD00008745
Hypostat
p-HOC6H4COEt
PHP
1-(4-Hydroxyphenyl)-1-propanone
Paroxon
Bio-Fren
Frenon
B 360
VANATONE

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
152-154 °C26 mm Hg(lit.)

[ Melting Point ]:
36-38 °C(lit.)

[ Molecular Formula ]:
C9H10O2

[ Molecular Weight ]:
150.174

[ Flash Point ]:
>230 °F

[ Exact Mass ]:
150.068085

[ PSA ]:
37.30000

[ LogP ]:
1.96

[ Vapour Pressure ]:
0.0±0.7 mmHg at 25°C

[ Index of Refraction ]:
1.542

[ Water Solubility ]:
0.34 g/l (15 ºC)

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UH1925000
CHEMICAL NAME :
Propiophenone, 4'-hydroxy-
CAS REGISTRY NUMBER :
70-70-2
BEILSTEIN REFERENCE NO. :
0907511
LAST UPDATED :
199701
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C9-H10-O2
MOLECULAR WEIGHT :
150.19
WISWESSER LINE NOTATION :
QR DV2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
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 :
NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. (Washington, DC) Volume(issue)/page/year: 5,29,1953
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1130 ug/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Behavioral - altered sleep time (including change in righting reflex) Lungs, Thorax, or Respiration - other changes
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 124,212,1960
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Parenteral
SPECIES OBSERVED :
Amphibian - frog
DOSE/DURATION :
91 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Behavioral - altered sleep time (including change in righting reflex) Lungs, Thorax, or Respiration - other changes
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 124,212,1960 ** REPRODUCTIVE DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intramuscular
DOSE :
1600 mg/kg
SEX/DURATION :
female 15-30 day(s) after conception
TOXIC EFFECTS :
Reproductive - Specific Developmental Abnormalities - eye/ear Reproductive - Specific Developmental Abnormalities - craniofacial (including nose and tongue) Reproductive - Effects on Newborn - stillbirth
REFERENCE :
AOGNAX Archivio di Ostetricia e Ginecologia. (C.C. Postale N 6/19773, Naples, Italy) V.1- 1894- Volume(issue)/page/year: 66,286,1961

Safety Information

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xn;Xi

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S37-S24/25-S36-S26

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
UH1925000

[ HS Code ]:
29145000

Precursor & DownStream

Precursor

  • Propanoyl chloride
  • Phenol
  • Propanoic acid, phenylester
  • 4'-Methoxypropiophenone
  • 4-Benzyloxy-propiophenone
  • N,N-Dimethylformamide
  • 4-Hydroxyacetophenone

DownStream

  • 1-[4-(6,7,8,9,10,11-hexahydrocycloocta[b]quinolin-12-yloxy)phenyl]propan-1-one
  • Diethylstilbestrol
  • 3,4-Bis(p-hydroxyphenyl)-3,4-hexanediol
  • (Z)-4,4'-(hex-3-ene-3,4-diyl)diphenol
  • 4'-(Benzyloxy)-2-bromopropiophenone
  • 4-Benzyloxy-propiophenone
  • 4'-Methoxypropiophenone
  • Desaminotyrosine
  • 1-[4-(2-MORPHOLIN-4-YL-ETHOXY)-PHENYL]-PROPAN-1-ONE
  • ethyl 2-[4-[[3-methyl-5-phenylmethoxy-2-(4-phenylmethoxyphenyl)indol-1-yl]methyl]phenoxy]acetate

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%

Articles

Convenient QSAR model for predicting the complexation of structurally diverse compounds with β-cyclodextrins

Bioorg. Med. Chem. 17 , 896-904, (2009)

This paper reports a QSAR study for predicting the complexation of a large and heterogeneous variety of substances (233 organic compounds) with beta-cyclodextrins (beta-CDs). Several different theoret...

Development of a phospholipidosis database and predictive quantitative structure-activity relationship (QSAR) models.

Toxicol. Mech. Methods 18 , 217-27, (2008)

ABSTRACT Drug-induced phospholipidosis (PL) is a condition characterized by the accumulation of phospholipids and drug in lysosomes, and is found in a variety of tissue types. PL is frequently manifes...

Inhibition of GABA shunt enzymes' activity by 4-hydroxybenzaldehyde derivatives.

Bioorg. Med. Chem. Lett. 16 , 592-5, (2006)

4-Hydroxybenzaldehyde (HBA) derivatives were examined as inhibitors for GABA transaminase (GABA-T) and succinic semialdehyde dehydrogenase (SSADH). Investigation of structure-activity relation reveale...


More Articles


Related Compounds

  • 2-amino-1-(4-hydroxyphenyl)propan-1-one
  • 2-bromo-1-(4-hydroxyphenyl)propan-1-one
  • 2-azido-1-(4-hydroxyphenyl)propan-1-one
  • 3-chloro-1-(4-hydroxyphenyl)propan-1-one
  • 2-hydroxy-1-(4-hydroxyphenyl)propan-1-one
  • 3-hydroxy-1-(4-hydroxyphenyl)propan-1-one
  • 2-[(2-Bromophenyl)sulfanyl]-1-cyclopropylethan-1-one
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide