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329-78-2 | 1-(4-Chlorophenyl)-2-fluoroethanone
CAS No: 329-78-2 Catalog No: AG0037NW MDL No:MFCD03412196
Product Description
Catalog Number:
AG0037NW
Chemical Name:
1-(4-Chlorophenyl)-2-fluoroethanone
CAS Number:
329-78-2
Molecular Formula:
C8H6ClFO
Molecular Weight:
172.5840
MDL Number:
MFCD03412196
IUPAC Name:
1-(4-chlorophenyl)-2-fluoroethanone
InChI:
InChI=1S/C8H6ClFO/c9-7-3-1-6(2-4-7)8(11)5-10/h1-4H,5H2
InChI Key:
PYJRFTYRPATKFJ-UHFFFAOYSA-N
SMILES:
FCC(=O)c1ccc(cc1)Cl
NSC Number:
265872
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.009g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.583g/mol
Monoisotopic Mass:
172.009g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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