CAS
898790-29-9 Purity
96%
898790-29-9 Purity
96%
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Cyclopropyl 3,4-difluorophenyl ketone
CAS
898790-32-4
Catalog Number
ACM898790324
Category
Other Products
Molecular Weight
182.17
Molecular Formula
C10H8F2O
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Specification
Synonyms
CYCLOPROPYL 3,4-DIFLUOROPHENYL KETONE;UKRORGSYN-BB BBV-5118523
IUPAC Name
cyclopropyl-(3,4-difluorophenyl)methanone
SMILES
C1CC1C(=O)C2=CC(=C(C=C2)F)F
InChI Key
ONVXAUXWUIDYPG-UHFFFAOYSA-N
Boiling Point
258.1ºC at 760 mmHg
Flash Point
98.4ºC
Density
1.313g/cm³
Exact Mass
182.05400
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of Cyclopropyl 3,4-difluorophenyl ketone?
The molecular formula is C10H8F2O.
When was Cyclopropyl 3,4-difluorophenyl ketone created on PubChem?
It was created on February 29, 2008.
What is the IUPAC name of Cyclopropyl 3,4-difluorophenyl ketone?
The IUPAC name is cyclopropyl-(3,4-difluorophenyl)methanone.
What is the InChIKey of Cyclopropyl 3,4-difluorophenyl ketone?
The InChIKey is ONVXAUXWUIDYPG-UHFFFAOYSA-N.
What is the Canonical SMILES of Cyclopropyl 3,4-difluorophenyl ketone?
The Canonical SMILES is C1CC1C(=O)C2=CC(=C(C=C2)F)F.
What is the molecular weight of Cyclopropyl 3,4-difluorophenyl ketone?
The molecular weight is 182.17 g/mol.
What is the XLogP3 value of Cyclopropyl 3,4-difluorophenyl ketone?
The XLogP3 value is 2.5.
How many hydrogen bond donor counts does Cyclopropyl 3,4-difluorophenyl ketone have?
It has 0 hydrogen bond donor counts.
How many rotatable bond count does Cyclopropyl 3,4-difluorophenyl ketone have?
It has 2 rotatable bond counts.
Is the compound canonicalized for Cyclopropyl 3,4-difluorophenyl ketone?
Yes, the compound is canonicalized.
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