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889-29-2 | Phenol, 2-[[(3-methoxyphenyl)imino]methyl]-
CAS No: 889-29-2 Catalog No: AG0048V5 MDL No:MFCD00020083
Product Description
Catalog Number:
AG0048V5
Chemical Name:
Phenol, 2-[[(3-methoxyphenyl)imino]methyl]-
CAS Number:
889-29-2
Molecular Formula:
C14H13NO2
Molecular Weight:
227.2585
MDL Number:
MFCD00020083
IUPAC Name:
2-[(3-methoxyphenyl)iminomethyl]phenol
InChI:
InChI=1S/C14H13NO2/c1-17-13-7-4-6-12(9-13)15-10-11-5-2-3-8-14(11)16/h2-10,16H,1H3
InChI Key:
PUORDCAAMKGOOK-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)N=Cc1ccccc1O
Properties
Complexity:
255
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:
1
Isotope Atom Count:
0
Molecular Weight:
227.263g/mol
Monoisotopic Mass:
227.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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