Introduction：Basic information about CAS 70-70-2|1-(4-Hydroxyphenyl)propan-1-one, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Paroxypropione is a manufactured, nonsteroidal estrogen which has been used medically as an antigonadotropin.
Related Catalog
Signaling Pathways >>Others >>OthersResearch Areas >>Endocrinology
References
[1]. Mombelli E. et al. Evaluation of the OECD (Q)SAR Application Toolbox for the profiling of estrogen receptorbinding affinities. SAR QSAR Environ Res. 2012 Jan;23(1-2):37-57.
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
InChIKey
RARSHUDCJQSEFJ-UHFFFAOYSA-N
SMILES
CCC(=O)c1ccc(O)cc1
Water Solubility
0.34 g/l (15 ºC)
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
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%
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