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87974-51-4 | Ethanone, 1-(5-chloro-2-hydroxyphenyl)-, oxime, (E)-
CAS No: 87974-51-4 Catalog No: AG004IF9 MDL No:
Product Description
Catalog Number:
AG004IF9
Chemical Name:
Ethanone, 1-(5-chloro-2-hydroxyphenyl)-, oxime, (E)-
CAS Number:
87974-51-4
Molecular Formula:
C8H8ClNO2
Molecular Weight:
185.6076
IUPAC Name:
4-chloro-2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenol
InChI:
InChI=1S/C8H8ClNO2/c1-5(10-12)7-4-6(9)2-3-8(7)11/h2-4,11-12H,1H3/b10-5+
InChI Key:
HKBDZIHVULROIL-BJMVGYQFSA-N
SMILES:
C/C(=N\O)/c1cc(Cl)ccc1O
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
185.024g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
185.607g/mol
Monoisotopic Mass:
185.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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