CAS
898790-21-1 Purity
96%
898790-21-1 Purity
96%
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4-Chloro-2-fluorophenyl cyclopropyl ketone
CAS
898790-24-4
Catalog Number
ACM898790244
Category
Other Products
Molecular Weight
198.62
Molecular Formula
C10H8ClFO
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Specification
Synonyms
4-CHLORO-2-FLUOROPHENYL CYCLOPROPYL KETONE
IUPAC Name
(4-chloro-2-fluorophenyl)-cyclopropylmethanone
Canonical SMILES
C1CC1C(=O)C2=C(C=C(C=C2)Cl)F
InChI Key
YXKWPFIGAHBKIM-UHFFFAOYSA-N
Boiling Point
282ºC at 760 mmHg
Flash Point
124.3ºC
Density
1.356g/cm³
Exact Mass
198.02500
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 4-Chloro-2-fluorophenyl cyclopropyl ketone?
The molecular formula of 4-Chloro-2-fluorophenyl cyclopropyl ketone is C10H8ClFO.
When was 4-Chloro-2-fluorophenyl cyclopropyl ketone created according to PubChem?
PubChem indicates that 4-Chloro-2-fluorophenyl cyclopropyl ketone was created on February 29, 2008.
What is the molecular weight of 4-Chloro-2-fluorophenyl cyclopropyl ketone?
The molecular weight of 4-Chloro-2-fluorophenyl cyclopropyl ketone is 198.62 g/mol.
What is the IUPAC name of 4-Chloro-2-fluorophenyl cyclopropyl ketone?
The IUPAC name of 4-Chloro-2-fluorophenyl cyclopropyl ketone is (4-chloro-2-fluorophenyl)-cyclopropylmethanone.
What is the Canonical SMILES representation of 4-Chloro-2-fluorophenyl cyclopropyl ketone?
The Canonical SMILES representation of 4-Chloro-2-fluorophenyl cyclopropyl ketone is C1CC1C(=O)C2=C(C=C(C=C2)Cl)F.
How many heavy atoms are there in the structure of 4-Chloro-2-fluorophenyl cyclopropyl ketone?
There are 13 heavy atoms in the structure of 4-Chloro-2-fluorophenyl cyclopropyl ketone.
What is the XLogP3-AA value of 4-Chloro-2-fluorophenyl cyclopropyl ketone?
The XLogP3-AA value of 4-Chloro-2-fluorophenyl cyclopropyl ketone is 2.8.
How many hydrogen bond acceptors are there in 4-Chloro-2-fluorophenyl cyclopropyl ketone?
There are 2 hydrogen bond acceptors in 4-Chloro-2-fluorophenyl cyclopropyl ketone.
Is 4-Chloro-2-fluorophenyl cyclopropyl ketone a canonicalized compound according to PubChem?
Yes, 4-Chloro-2-fluorophenyl cyclopropyl ketone is a canonicalized compound according to PubChem.
What is the InChIKey of 4-Chloro-2-fluorophenyl cyclopropyl ketone?
The InChIKey of 4-Chloro-2-fluorophenyl cyclopropyl ketone is YXKWPFIGAHBKIM-UHFFFAOYSA-N.
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