CAS
898790-65-3 Purity
96%
898790-65-3 Purity
96%
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Cyclobutyl 2,4-dimethylphenyl ketone
CAS
898790-68-6
Catalog Number
ACM898790686
Category
Other Products
Molecular Weight
188.27
Molecular Formula
C13H16O
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Specification
Synonyms
CYCLOBUTYL 2,4-DIMETHYLPHENYL KETONE;CYCLOBUTYL(2,4-DIMETHYLPHENYL)METHANONE
IUPAC Name
cyclobutyl-(2,4-dimethylphenyl)methanone
Canonical SMILES
CC1=CC(=C(C=C1)C(=O)C2CCC2)C
InChI Key
JZCNVUQXOTVPQU-UHFFFAOYSA-N
Boiling Point
297.2ºC at 760 mmHg
Flash Point
124.1ºC
Density
1.042g/cm³
Exact Mass
188.12000
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of Cyclobutyl 2,4-dimethylphenyl ketone?
The molecular formula of Cyclobutyl 2,4-dimethylphenyl ketone is C13H16O.
When was Cyclobutyl 2,4-dimethylphenyl ketone created and last modified in the PubChem database?
Cyclobutyl 2,4-dimethylphenyl ketone was created on 2008-02-29 and last modified on 2023-12-30 in the PubChem database.
What is the IUPAC name of Cyclobutyl 2,4-dimethylphenyl ketone?
The IUPAC name of Cyclobutyl 2,4-dimethylphenyl ketone is cyclobutyl-(2,4-dimethylphenyl)methanone.
What is the InChIKey of Cyclobutyl 2,4-dimethylphenyl ketone?
The InChIKey of Cyclobutyl 2,4-dimethylphenyl ketone is JZCNVUQXOTVPQU-UHFFFAOYSA-N.
What is the molecular weight of Cyclobutyl 2,4-dimethylphenyl ketone?
The molecular weight of Cyclobutyl 2,4-dimethylphenyl ketone is 188.26 g/mol.
How many hydrogen bond acceptor counts does Cyclobutyl 2,4-dimethylphenyl ketone have?
Cyclobutyl 2,4-dimethylphenyl ketone has 1 hydrogen bond acceptor count.
What is the exact mass of Cyclobutyl 2,4-dimethylphenyl ketone?
The exact mass of Cyclobutyl 2,4-dimethylphenyl ketone is 188.120115130 g/mol.
How many rotatable bond counts does Cyclobutyl 2,4-dimethylphenyl ketone have?
Cyclobutyl 2,4-dimethylphenyl ketone has 2 rotatable bond counts.
Is Cyclobutyl 2,4-dimethylphenyl ketone a canonical compound in the PubChem database?
Yes, Cyclobutyl 2,4-dimethylphenyl ketone is a canonicalized compound in the PubChem database.
What is the topological polar surface area of Cyclobutyl 2,4-dimethylphenyl ketone?
The topological polar surface area of Cyclobutyl 2,4-dimethylphenyl ketone is 17.1 A^2.
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