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102494-22-4 | Ethanone, 1-[4-(2-hydroxyethyl)phenyl]-, oxime
CAS No: 102494-22-4 Catalog No: AG0007KJ MDL No:
Product Description
Catalog Number:
AG0007KJ
Chemical Name:
Ethanone, 1-[4-(2-hydroxyethyl)phenyl]-, oxime
CAS Number:
102494-22-4
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
IUPAC Name:
2-[4-(N-hydroxy-C-methylcarbonimidoyl)phenyl]ethanol
InChI:
InChI=1S/C10H13NO2/c1-8(11-13)10-4-2-9(3-5-10)6-7-12/h2-5,12-13H,6-7H2,1H3
InChI Key:
HNWVDJLQTKGEHZ-UHFFFAOYSA-N
SMILES:
OCCc1ccc(cc1)C(=NO)C
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.219g/mol
Monoisotopic Mass:
179.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.4
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