3,5-dimethyl isoxazole

isoxazole, 3,5-dimethyl-

CAS: 300-87-8 C5 H7 N O MW: 97.11699000

Identification

Name3,5-dimethyl isoxazole
IUPAC3,5-dimethyl-1,2-oxazole
CAS Number300-87-8
EINECS206-100-2
FDA UNIIJS7C0HP303
Molecular FormulaC5 H7 N O
Molecular Weight97.11699000
Nikkaji NumberJ47.753B
Beilstein0106324

Regulatory

Physical Properties

Appearance colorless to pale yellow clear liquid (est)
Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Specific Gravity 0.98400 to 0.98700 @ 20.00 °C.
Pounds per Gallon - (est). 8.197 to 8.222
Refractive Index 1.44000 to 1.44300 @ 20.00 °C.
Melting Point -14.00 °C. @ 760.00 mm Hg
Boiling Point 143.00 °C. @ 760.00 mm Hg
Vapor Pressure 6.505000 mmHg @ 25.00 °C. (est)
Flash Point 88.00 °F. TCC ( 31.11 °C. )
logP (o/w) 1.431 (est)
Soluble in water, 9083 mg/L @ 25 °C (est)

No sensory data available

Safety Information

Preferred SDSView
Oral/Parenteral Toxicityintraperitoneal-mouse LD50 880 mg/kg
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categorynatural substances and extractives
Recommendation for 3,5-dimethyl isoxazole usage levels up tonot for fragrance use.
Recommendation for 3,5-dimethyl isoxazole flavor usage levels up tonot for flavor use.

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Potential Uses

None Found

Natural Occurrence

coffee PMC

Synonyms

3,5- dimethyl-1,2-oxazole 3,5- dimethylisoxazole dimexazol iso xazole, 3,5-dimethyl- Try the PubMed Search.