ChemicalBook--->CAS DataBase List--->512-85-6

512-85-6

512-85-6 Structure

512-85-6 Structure
IdentificationBack Directory
[Name]

ASCARIDOLE
[CAS]

512-85-6
[Synonyms]

Kebal II
Ascaricum
Ascaridol
Ascarisin
Askaridol
Ascapurin
Ascaridiol
Uncinacina
NSC 406266
NSC 406924
ASCARIDOLE
Boldo ascaridole
Ascaridole epoxide
1,4-Peroxy-p-menth-2-ene
1,4-Peroxido-p-menthene-2
1,4-epidioxy-2-p-menthene
1,4-Epidioxy-p-menth-2-ene
1,4-Epidioxy-p-mentha-2-ene
p-Menth-2-ene, 1,4-epidioxy-
PARA-MENTH-2-ENE,1,4-EPIDIOXY-
Chenopodium oil (acetive component)
4-Isopropyl-1-methyl-2,3-dioxabicyclo[2.2.2]oct-5-ene
1-isopropyl-4-methyl-7,8-dioxabicyclo[2.2.2]oct-2-ene
1-Isopropyl-4-methyl-2,3-dioxabicyclo[2.2.2]oct-5-ene
1-Isopropyl-4-methyl-2,3-dioxabicyclo[2.2.2]octa-5-ene
4-methyl-1-propan-2-yl-7,8-dioxabicyclo[2.2.2]oct-2-ene
2,3-Dioxabicyclo(2.2.2)oct-5-ene, 1-isopropyl-4-methyl-
1-Methyl-4-(1-methylethyl)-2,3-dioxabicyclo(2.2.2)oct-5-ene
2,3-Dioxabicyclo[2.2.2]oct-5-ene,1-Methyl-4-(1-Methylethyl)-
[EINECS(EC#)]

208-147-4
[Molecular Formula]

C10H16O2
[MDL Number]

MFCD01715732
[MOL File]

512-85-6.mol
[Molecular Weight]

168.23
Chemical PropertiesBack Directory
[Melting point ]

106-107℃ (dec.)
[Boiling point ]

172.3±20.0℃
[density ]

1.051±0.06 g/cm3 (20 ºC 760 Torr)
[refractive index ]

1.4769 (589.3 nm, 25℃)
[Fp ]

55.9±28.6℃
[storage temp. ]

Amber Vial, -20?C Freezer
[form ]

Liquid
[color ]

Colorless unstable liquid
[Optical Rotation]

-0.520
[InChI]

InChI=1S/C10H16O2/c1-8(2)10-6-4-9(3,5-7-10)11-12-10/h4,6,8H,5,7H2,1-3H3
[InChIKey]

MGYMHQJELJYRQS-UHFFFAOYSA-N
[SMILES]

C12(C)CCC(C(C)C)(C=C1)OO2
[LogP]

2.244 (est)
[EPA Substance Registry System]

2,3-Dioxabicyclo(2.2.2)oct-5-ene, 1-methyl-4-(1-methylethyl)- (512-85-6)
Hazard InformationBack Directory
[Chemical Properties]

Pale Yellow Oil
[Uses]

An organic peroxide which constitutes 60-80% of oil of chenopodium. Anthelmintic.
[Definition]

ChEBI: A p-menthane monoterpenoid that is p-menth-2-ene with a peroxy group across position 1 to 4.
[Hazard]

Strong oxidizing agent, explodes on heating to 130C or in contact with organic acids.
Safety DataBack Directory
[Safety Profile]

Poison by ingestion. Questionable carcinogen with experimental neoplastigenic and tumorigenic data. Flammable by spontaneous chemical reaction. An oxidizer. Explodes when heated > 130℃ or when exposed to organic acids. Dangerous; heating emits toxic fumes and may explode; reacts with reducing materials. See also CHENOPODIUM OIL and PEROXIDES, ORGANIC.
[Toxicity]

LD50 orl-rat: 200 mg/kg FEPRA7 7,252,48
Spectrum DetailBack Directory
[Spectrum Detail]

ASCARIDOLE(512-85-6)1HNMR
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