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820212-74-6 | Phenol, 2,6-bis[[(4-hydroxyphenyl)imino]methyl]-4-methyl-
CAS No: 820212-74-6 Catalog No: AG0053QI MDL No:
Product Description
Catalog Number:
AG0053QI
Chemical Name:
Phenol, 2,6-bis[[(4-hydroxyphenyl)imino]methyl]-4-methyl-
CAS Number:
820212-74-6
Molecular Formula:
C21H18N2O3
Molecular Weight:
346.3792
IUPAC Name:
2,6-bis[(4-hydroxyphenyl)iminomethyl]-4-methylphenol
InChI:
InChI=1S/C21H18N2O3/c1-14-10-15(12-22-17-2-6-19(24)7-3-17)21(26)16(11-14)13-23-18-4-8-20(25)9-5-18/h2-13,24-26H,1H3
InChI Key:
VSRWRHTYODSQEG-UHFFFAOYSA-N
SMILES:
Cc1cc(C=Nc2ccc(cc2)O)c(c(c1)C=Nc1ccc(cc1)O)O
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.132g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
346.386g/mol
Monoisotopic Mass:
346.132g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
85.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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