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121872-96-6 | Benzoyl fluoride, 2-chloro-4,5-difluoro-
CAS No: 121872-96-6 Catalog No: AG00166Z MDL No:
Product Description
Catalog Number:
AG00166Z
Chemical Name:
Benzoyl fluoride, 2-chloro-4,5-difluoro-
CAS Number:
121872-96-6
Molecular Formula:
C7H2ClF3O
Molecular Weight:
194.5384
IUPAC Name:
2-chloro-4,5-difluorobenzoyl fluoride
InChI:
InChI=1S/C7H2ClF3O/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2H
InChI Key:
XEBNBRGYFQUIJV-UHFFFAOYSA-N
SMILES:
FC(=O)c1cc(F)c(cc1Cl)F
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.975g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.537g/mol
Monoisotopic Mass:
193.975g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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