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1352232-11-1 | 2-Chloro-1-(3,4-dimethoxyphenyl)-2,2-difluoroethanone
CAS No: 1352232-11-1 Catalog No: AG01F88R MDL No:
Product Description
Catalog Number:
AG01F88R
Chemical Name:
2-Chloro-1-(3,4-dimethoxyphenyl)-2,2-difluoroethanone
CAS Number:
1352232-11-1
Molecular Formula:
C10H9ClF2O3
Molecular Weight:
250.6265
IUPAC Name:
2-chloro-1-(3,4-dimethoxyphenyl)-2,2-difluoroethanone
InChI:
InChI=1S/C10H9ClF2O3/c1-15-7-4-3-6(5-8(7)16-2)9(14)10(11,12)13/h3-5H,1-2H3
InChI Key:
HIGZOXSQDOTWPG-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)C(=O)C(Cl)(F)F
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.021g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.626g/mol
Monoisotopic Mass:
250.021g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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