CAS
898791-15-6 Purity
96%
898791-15-6 Purity
96%
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Cyclobutyl 2,5-dichlorophenyl ketone
CAS
898791-18-9
Catalog Number
ACM898791189
Category
Other Products
Molecular Weight
229.1
Molecular Formula
C11H10Cl2O
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Specification
Synonyms
CYCLOBUTYL 2,5-DICHLOROPHENYL KETONE
IUPAC Name
cyclobutyl-(2,5-dichlorophenyl)methanone
InChI Key
UNVVXADOVGGKOB-UHFFFAOYSA-N
Boiling Point
307.8ºC at 760 mmHg
Flash Point
129.2ºC
Density
1.332g/cm³
Exact Mass
228.01100
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of Cyclobutyl 2,5-dichlorophenyl ketone?
The molecular formula of Cyclobutyl 2,5-dichlorophenyl ketone is C11H10Cl2O.
When was Cyclobutyl 2,5-dichlorophenyl ketone created in PubChem?
Cyclobutyl 2,5-dichlorophenyl ketone was created in PubChem on February 29, 2008.
What is the IUPAC name of Cyclobutyl 2,5-dichlorophenyl ketone?
The IUPAC name of Cyclobutyl 2,5-dichlorophenyl ketone is cyclobutyl-(2,5-dichlorophenyl)methanone.
What is the InChIKey of Cyclobutyl 2,5-dichlorophenyl ketone?
The InChIKey of Cyclobutyl 2,5-dichlorophenyl ketone is UNVVXADOVGGKOB-UHFFFAOYSA-N.
What is the Canonical SMILES representation of Cyclobutyl 2,5-dichlorophenyl ketone?
The Canonical SMILES representation of Cyclobutyl 2,5-dichlorophenyl ketone is C1CC(C1)C(=O)C2=C(C=CC(=C2)Cl)Cl.
What is the molecular weight of Cyclobutyl 2,5-dichlorophenyl ketone?
The molecular weight of Cyclobutyl 2,5-dichlorophenyl ketone is 229.10 g/mol.
How many hydrogen bond acceptors does Cyclobutyl 2,5-dichlorophenyl ketone have?
Cyclobutyl 2,5-dichlorophenyl ketone has 1 hydrogen bond acceptor.
What is the XLogP3-AA value for Cyclobutyl 2,5-dichlorophenyl ketone?
The XLogP3-AA value for Cyclobutyl 2,5-dichlorophenyl ketone is 3.9.
Is Cyclobutyl 2,5-dichlorophenyl ketone a canonicalized compound?
Yes, Cyclobutyl 2,5-dichlorophenyl ketone is a canonicalized compound.
How many rotatable bond counts does Cyclobutyl 2,5-dichlorophenyl ketone have?
Cyclobutyl 2,5-dichlorophenyl ketone has 2 rotatable bond counts.
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