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81029-87-0 | 2-CHLORO-3'-FLUOROBENZOPHENONE
CAS No: 81029-87-0 Catalog No: AG005HIJ MDL No:
Product Description
Catalog Number:
AG005HIJ
Chemical Name:
2-CHLORO-3'-FLUOROBENZOPHENONE
CAS Number:
81029-87-0
Molecular Formula:
C13H8ClFO
Molecular Weight:
234.6534
IUPAC Name:
(2-chlorophenyl)-(3-fluorophenyl)methanone
InChI:
InChI=1S/C13H8ClFO/c14-12-7-2-1-6-11(12)13(16)9-4-3-5-10(15)8-9/h1-8H
InChI Key:
GNAXMPCQUQCCAO-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C(=O)c1ccccc1Cl
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.025g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.654g/mol
Monoisotopic Mass:
234.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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