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128076-64-2 | Ethanone, 1-(2-amino-5-fluorophenyl)-2-chloro-
CAS No: 128076-64-2 Catalog No: AG000XQV MDL No:
Product Description
Catalog Number:
AG000XQV
Chemical Name:
Ethanone, 1-(2-amino-5-fluorophenyl)-2-chloro-
CAS Number:
128076-64-2
Molecular Formula:
C8H7ClFNO
Molecular Weight:
187.5987
IUPAC Name:
1-(2-amino-5-fluorophenyl)-2-chloroethanone
InChI:
InChI=1S/C8H7ClFNO/c9-4-8(12)6-3-5(10)1-2-7(6)11/h1-3H,4,11H2
InChI Key:
IZAPRVJOMNGPLC-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1C(=O)CCl)F
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.02g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.598g/mol
Monoisotopic Mass:
187.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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