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820212-71-3 | Phenol, 4-(1,1-dimethylethyl)-2,6-bis[[(4-methylphenyl)imino]methyl]-
CAS No: 820212-71-3 Catalog No: AG004YG5 MDL No:
Product Description
Catalog Number:
AG004YG5
Chemical Name:
Phenol, 4-(1,1-dimethylethyl)-2,6-bis[[(4-methylphenyl)imino]methyl]-
CAS Number:
820212-71-3
Molecular Formula:
C26H28N2O
Molecular Weight:
384.5133
IUPAC Name:
4-tert-butyl-2,6-bis[(4-methylphenyl)iminomethyl]phenol
InChI:
InChI=1S/C26H28N2O/c1-18-6-10-23(11-7-18)27-16-20-14-22(26(3,4)5)15-21(25(20)29)17-28-24-12-8-19(2)9-13-24/h6-17,29H,1-5H3
InChI Key:
VVMTTXDIXSACQQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)N=Cc1cc(cc(c1O)C=Nc1ccc(cc1)C)C(C)(C)C
Properties
Complexity:
506
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.22g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
384.523g/mol
Monoisotopic Mass:
384.22g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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