1-(2,3,6-Trimethylphenyl)but-3-en-2-one

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Catalog Number

ACM54789456

Product Name

Structure

CAS

54789-45-6

Category

Heterocyclic Organic Compound

Synonyms

CID41183, 1-(2,3,6-TRIMETHYLPHENYL)-3-BUTEN-2-ONE, 3-Buten-2-one, 1-(2,3,6-trimethylphenyl)-, 54789-45-6

IUPAC Name

1-(2,3,6-trimethylphenyl)but-3-en-2-one

Molecular Weight

188.266 g/mol

Molecular Formula

C₁₃H₁₆O

Canonical SMILES

CC1=C(C(=C(C=C1)C)CC(=O)C=C)C

InChI Key

KBGDCKHDBZJUKE-UHFFFAOYSA-N

Boiling Point

305.6ºC at 760 mmHg

Flash Point

112.7ºC

Density

0.959g/cm³

Exact Mass

188.12000

H-Bond Acceptor

H-Bond Donor

MSDS

COA

Spec Sheet

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