2-Hydroxy-3-methyl-2-cyclopentenone

CAS No. 80-71-7

Formula: C6H8O2
Basic Info

Formula
C6H8O2
Molecular Weight
112.127
Exact Mass
112.052
LogP
1.1813
PSA
37.3
Synonyms

2-Cyclopenten-1-one, 2-hydroxy-3-methyl-

Methyl cyclopentenolone

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Properties
Appearance & Physical State
White to light yellow crystalline powder
Density
1.225 g/cm3
Boiling Point
245.2ºC at 760 mmHg
Melting Point
104-108ºC
Flash Point
100.7ºC
Safety Info
RTECS
GY7298000
HS Code
2914190090
Spectrum
NMR Spectrum 1H NMR : Predict
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Mass Spectrum Mass spectrum (electron ionization)
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Toxicity
ACUTE TOXICITY DATA
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Type of Test
LDLo - Lowest published lethal dose
Exposure Route
Intraperitoneal
Species Observed
Rodent - rat
Dose/Duration
500 mg/kg
Toxic Effects
Details of toxic effects not reported other than lethal dose value--
Reference
Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,809,1976
ACUTE TOXICITY DATA
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Type of Test
LDLo - Lowest published lethal dose
Exposure Route
Intraperitoneal
Species Observed
Rodent - mouse
Dose/Duration
500 mg/kg
Toxic Effects
Details of toxic effects not reported other than lethal dose value--
Reference
Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,809,1976
ACUTE TOXICITY DATA
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Type of Test
LD50 - Lethal dose, 50 percent kill
Exposure Route
Oral
Species Observed
Rodent - guinea pig
Dose/Duration
1400 mg/kg
Toxic Effects
Details of toxic effects not reported other than lethal dose value--
Reference
Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,809,1976
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