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121639-61-0 | Benzeneacetyl chloride, 3,4-difluoro-
CAS No: 121639-61-0 Catalog No: AG0015GC MDL No:MFCD08458138
Product Description
Catalog Number:
AG0015GC
Chemical Name:
Benzeneacetyl chloride, 3,4-difluoro-
CAS Number:
121639-61-0
Molecular Formula:
C8H5ClF2O
Molecular Weight:
190.5745
MDL Number:
MFCD08458138
IUPAC Name:
2-(3,4-difluorophenyl)acetyl chloride
InChI:
InChI=1S/C8H5ClF2O/c9-8(12)4-5-1-2-6(10)7(11)3-5/h1-3H,4H2
InChI Key:
NHXZDVXZDDNPFM-UHFFFAOYSA-N
SMILES:
ClC(=O)Cc1ccc(c(c1)F)F
Properties
Complexity:
174
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:
2.6
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