CAS
493665 Purity
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493665 Purity
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5-Phenylcyclohexane-1,3-dione
CAS
493-72-1
Catalog Number
ACM493721
Category
Other Products
Molecular Weight
188.226g/mol
Molecular Formula
C12H12O2;
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Specification
Synonyms
SBB061998; AC1LC3L5; ANW-30765; 6688AB; ACMC-1ANML; F0265-0877; MFCD00051846; CTK4J1268; ST24029550; 5-Phenylcyclohexane-1,3-dione;
IUPAC Name
5-phenylcyclohexane-1,3-dione;
Canonical SMILES
C1C(CC(=O)CC1=O)C2=CC=CC=C2;
InChI
InChI=1S/C12H12O2/c13-11-6-10(7-12(14)8-11)9-4-2-1-3-5-9/h1-5,10H,6-8H2;
InChI Key
UPPYKNLSSLIIAZ-UHFFFAOYSA-N;
Complexity
223
Covalently-Bonded Unit Count
1
Exact Mass
188.084g/mol
H-Bond Acceptor
2
Heavy Atom Count
14
Monoisotopic Mass
188.084g/mol
Rotatable Bond Count
1
Topological Polar Surface Area
34.1A^2
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