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1252665-86-3 | 1-Propanone, 3-chloro-1-(2,3-difluorophenyl)-
CAS No: 1252665-86-3 Catalog No: AG000NEL MDL No:
Product Description
Catalog Number:
AG000NEL
Chemical Name:
1-Propanone, 3-chloro-1-(2,3-difluorophenyl)-
CAS Number:
1252665-86-3
Molecular Formula:
C9H7ClF2O
Molecular Weight:
204.6011
IUPAC Name:
3-chloro-1-(2,3-difluorophenyl)propan-1-one
InChI:
InChI=1S/C9H7ClF2O/c10-5-4-8(13)6-2-1-3-7(11)9(6)12/h1-3H,4-5H2
InChI Key:
OTVRLARBYBNRQV-UHFFFAOYSA-N
SMILES:
Fc1c(cccc1F)C(=O)CCCl
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.015g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.601g/mol
Monoisotopic Mass:
204.015g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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