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Structure

2-Cyclohexen-1-one,4,4-dimethyl-

CAS
1073-13-8
Catalog Number
ACM1073138
Category
Other Products
Molecular Weight
124.18
Molecular Formula
C8H12O

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Specification

Synonyms
4,4-Dimethyl-2-cyclohexen-1-one, 2-Cyclohexen-1-one, 4,4-dimethyl-, 245542_ALDRICH, ZINC04262417, 4,4-dimethylcyclohex-2-en-1-one, CID136839, 1073-13-8, InChI=1/C8H12O/c1-8(2)5-3-7(9)4-6-8/h3,5H,4,6H2,1-2H
IUPAC Name
4,4-dimethylcyclohex-2-en-1-one
Canonical SMILES
CC1(CCC(=O)C=C1)C
InChI Key
HAUNPYVLVAIUOO-UHFFFAOYSA-N
Boiling Point
72-73.5ºC20 mm Hg(lit.)
Flash Point
148 °F
Density
0.944 g/mL at 25ºC(lit.)
Appearance
CLEAR DARK BROWN LIQUID
Exact Mass
124.08900
Hazard Statements
Xn,Xi
H-Bond Acceptor
1
H-Bond Donor
0
Safety Description
S36/37/39
WGK Germany
3
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