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Home > Product > Heterocyclic Organic Compounds > 1-(2,3,6-Trimethylphenyl)but-3-en-2-one

1-(2,3,6-Trimethylphenyl)but-3-en-2-one | CAS Number: 54789-45-6

Catalog Number
ACM54789456
Product Name
1-(2,3,6-Trimethylphenyl)but-3-en-2-one
Structure
CAS Number
54789-45-6
IUPAC Name
1-(2,3,6-trimethylphenyl)but-3-en-2-one
Synonyms
CID41183, 1-(2,3,6-TRIMETHYLPHENYL)-3-BUTEN-2-ONE, 3-Buten-2-one, 1-(2,3,6-trimethylphenyl)-, 54789-45-6
Molecular Weight
188.266 g/mol
Exact Mass
188.12000
Molecular Formula
C13H16O
Boiling Point
305.6ºC at 760 mmHg
Flash Point
112.7ºC
Density
0.959g/cm3
Purity
96%
SMILES
CC1=C(C(=C(C=C1)C)CC(=O)C=C)C
InChIKey
KBGDCKHDBZJUKE-UHFFFAOYSA-N
H-Bond Donor
0
H-Bond Acceptor
1
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