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384-67-8 | 2-Chloro-2,2-difluoro-1-phenylethanone
CAS No: 384-67-8 Catalog No: AG003B6S MDL No:MFCD00042123
Product Description
Catalog Number:
AG003B6S
Chemical Name:
2-Chloro-2,2-difluoro-1-phenylethanone
CAS Number:
384-67-8
Molecular Formula:
C8H5ClF2O
Molecular Weight:
190.5745
MDL Number:
MFCD00042123
IUPAC Name:
2-chloro-2,2-difluoro-1-phenylethanone
InChI:
InChI=1S/C8H5ClF2O/c9-8(10,11)7(12)6-4-2-1-3-5-6/h1-5H
InChI Key:
MNOONJNILVDLSW-UHFFFAOYSA-N
SMILES:
O=C(C(Cl)(F)F)c1ccccc1
NSC Number:
42611
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.574g/mol
Monoisotopic Mass:
190g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| 2-Chloro-2,2-difluoroacetophenone: a non-ODS-based difluorocarbene precursor and its use in the difluoromethylation of phenol derivatives. | The Journal of organic chemistry 20061222 |
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