CAS
898791-61-2 Purity
96%
898791-61-2 Purity
96%
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Cyclopentyl 2-trifluoromethylphenyl ketone
CAS
898791-64-5
Catalog Number
ACM898791645
Category
Other Products
Molecular Weight
242.24
Molecular Formula
C13H13F3O
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Specification
Synonyms
CYCLOPENTYL 2-TRIFLUOROMETHYLPHENYL KETONE
IUPAC Name
cyclopentyl-[2-(trifluoromethyl)phenyl]methanone
Canonical SMILES
C1CCC(C1)C(=O)C2=CC=CC=C2C(F)(F)F
InChI Key
PDYIDWQRBBRPBZ-UHFFFAOYSA-N
Boiling Point
294ºC at 760 mmHg
Flash Point
146.8ºC
Density
1.215g/cm³
Exact Mass
242.09200
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of Cyclopentyl 2-trifluoromethylphenyl ketone?
The molecular formula of Cyclopentyl 2-trifluoromethylphenyl ketone is C13H13F3O.
When was Cyclopentyl 2-trifluoromethylphenyl ketone created in PubChem?
Cyclopentyl 2-trifluoromethylphenyl ketone was created in PubChem on February 29, 2008.
What is the IUPAC name of Cyclopentyl 2-trifluoromethylphenyl ketone?
The IUPAC name of Cyclopentyl 2-trifluoromethylphenyl ketone is cyclopentyl-[2-(trifluoromethyl)phenyl]methanone.
What is the InChIKey of Cyclopentyl 2-trifluoromethylphenyl ketone?
The InChIKey of Cyclopentyl 2-trifluoromethylphenyl ketone is PDYIDWQRBBRPBZ-UHFFFAOYSA-N.
How many hydrogen bond acceptors does Cyclopentyl 2-trifluoromethylphenyl ketone have?
Cyclopentyl 2-trifluoromethylphenyl ketone has 4 hydrogen bond acceptors.
What is the exact mass of Cyclopentyl 2-trifluoromethylphenyl ketone?
The exact mass of Cyclopentyl 2-trifluoromethylphenyl ketone is 242.09184952 g/mol.
How many rotatable bonds does Cyclopentyl 2-trifluoromethylphenyl ketone have?
Cyclopentyl 2-trifluoromethylphenyl ketone has 2 rotatable bonds.
Is Cyclopentyl 2-trifluoromethylphenyl ketone a canonicalized compound?
Yes, Cyclopentyl 2-trifluoromethylphenyl ketone is a canonicalized compound.
What is the XLogP3-AA value for Cyclopentyl 2-trifluoromethylphenyl ketone?
The XLogP3-AA value for Cyclopentyl 2-trifluoromethylphenyl ketone is 4.
How many covalently-bonded units are in Cyclopentyl 2-trifluoromethylphenyl ketone?
There is 1 covalently-bonded unit in Cyclopentyl 2-trifluoromethylphenyl ketone.
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