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100542-74-3 | Phenol, 4-chloro-2-[[(4-methoxyphenyl)imino]methyl]-
CAS No: 100542-74-3 Catalog No: AG0002A7 MDL No:
Product Description
Catalog Number:
AG0002A7
Chemical Name:
Phenol, 4-chloro-2-[[(4-methoxyphenyl)imino]methyl]-
CAS Number:
100542-74-3
Molecular Formula:
C14H12ClNO2
Molecular Weight:
261.7036
IUPAC Name:
4-chloro-2-[(4-methoxyphenyl)iminomethyl]phenol
InChI:
InChI=1S/C14H12ClNO2/c1-18-13-5-3-12(4-6-13)16-9-10-8-11(15)2-7-14(10)17/h2-9,17H,1H3
InChI Key:
FYGRJBYYFWNZLL-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)N=Cc1cc(Cl)ccc1O
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.056g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
261.705g/mol
Monoisotopic Mass:
261.056g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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