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72569-66-5

72569-66-5 structure
72569-66-5 structure

Name methyl 3-butan-2-yl-3-methyloxirane-2-carboxylate
Synonyms 3-sec-Butyl-3-methylglycidic acid methyl ester
GLYCIDIC ACID,3-sec-BUTYL-3-METHYL-,METHYL ESTER
3-sec-butyl-3-methyloxirane-2-carboxylic acid methyl ester
methyl 3-sec-butyl-3-methylglycidate
2,3-epoxy-3,4-dimethyl-hexanoic acid methyl ester
Glycidic acid,methyl ester
2,3-Epoxy-3,4-dimethyl-hexansaeure-methylester
Density 1.019g/cm3
Boiling Point 187.2ºC at 760 mmHg
Molecular Formula C9H16O3
Molecular Weight 172.22200
Flash Point 68.6ºC
Exact Mass 172.11000
PSA 38.83000
LogP 1.36300
Index of Refraction 1.444

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MB4950000
CHEMICAL NAME :
Glycidic acid, 3-sec-butyl-3-methyl-, methyl ester
CAS REGISTRY NUMBER :
72569-66-5
BEILSTEIN REFERENCE NO. :
0123065
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H16-O3
MOLECULAR WEIGHT :
172.25
WISWESSER LINE NOTATION :
2Y1&Y1&VVO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
178 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#00411

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72569-66-5 structure

72569-66-5

Literature: Trubek Labor. Inc. Patent: US2889339 , 1956 ;

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72569-66-5 structure

72569-66-5

Literature: International Flavors and Fragrances Inc.; Gavalda, Juan Adell; Narula, Anubhav P.S.; Perez, Ana Maria Collado Patent: US2014/81034 A1, 2014 ;