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Structure

5-[3,4(Methylenedioxy)phenyl]-1,3-cyclohexanedione

CAS
55579-76-5
Catalog Number
ACM55579765
Category
Other Products
Molecular Weight
232.23
Molecular Formula
C13H12O4

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Specification

Synonyms
55579-76-5, 5-(1,3-benzodioxol-5-yl)cyclohexane-1,3-dione, 5-(2H-1,3-Benzodioxol-5-Yl)Cyclohexane-1,3-Dione, 5-[3,4-(Methylenedioxy)phenyl]-1,3-cyclohexanedione, Maybridge1_003278, AC1MCRJB, AC1Q6ECR, ACMC-1AN7R, SureCN5330757, Oprea1_651765, 539864_ALDRICH, CTK5A3827, HMS550M22, MolPort-001-763-216, ZINC04640335, AKOS015889606, CD11317, KB-195453, FT-0619559, 1,3-Cyclohexanedione,5-(1,3-benzodioxol-5-yl)-
IUPAC Name
5-(1,3-benzodioxol-5-yl)cyclohexane-1,3-dione
Canonical SMILES
C1C(CC(=O)CC1=O)C2=CC3=C(C=C2)OCO3
InChI Key
BNXUYPAIVILSTN-UHFFFAOYSA-N
Boiling Point
413.5ºC at 760mmHg
Melting Point
179-181ºC(lit.)
Flash Point
187.3ºC
Density
1.328g/cm³
Exact Mass
232.07400
H-Bond Acceptor
4
H-Bond Donor
0
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