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88126-67-4 | [1,1'-Biphenyl]-3-carboxaldehyde, 4-hydroxy-4'-methyl-, oxime
CAS No: 88126-67-4 Catalog No: AG004DUT MDL No:
Product Description
Catalog Number:
AG004DUT
Chemical Name:
[1,1'-Biphenyl]-3-carboxaldehyde, 4-hydroxy-4'-methyl-, oxime
CAS Number:
88126-67-4
Molecular Formula:
C14H13NO2
Molecular Weight:
227.2585
IUPAC Name:
2-(hydroxyiminomethyl)-4-(4-methylphenyl)phenol
InChI:
InChI=1S/C14H13NO2/c1-10-2-4-11(5-3-10)12-6-7-14(16)13(8-12)9-15-17/h2-9,16-17H,1H3
InChI Key:
BFBOOVBYVCPUPU-UHFFFAOYSA-N
SMILES:
ON=Cc1cc(ccc1O)c1ccc(cc1)C
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.095g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
227.263g/mol
Monoisotopic Mass:
227.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.3
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