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87974-53-6 | Methanone, (5-chloro-2-hydroxyphenyl)phenyl-, oxime, (E)-
CAS No: 87974-53-6 Catalog No: AG004LWV MDL No:
Product Description
Catalog Number:
AG004LWV
Chemical Name:
Methanone, (5-chloro-2-hydroxyphenyl)phenyl-, oxime, (E)-
CAS Number:
87974-53-6
Molecular Formula:
C13H10ClNO2
Molecular Weight:
247.6770
IUPAC Name:
4-chloro-2-(N-hydroxy-C-phenylcarbonimidoyl)phenol
InChI:
InChI=1S/C13H10ClNO2/c14-10-6-7-12(16)11(8-10)13(15-17)9-4-2-1-3-5-9/h1-8,16-17H
InChI Key:
OMPLYQXUVONCER-UHFFFAOYSA-N
SMILES:
O/N=C(/c1cc(Cl)ccc1O)\c1ccccc1
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.04g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
247.678g/mol
Monoisotopic Mass:
247.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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