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1620-82-2 | Phenol, 2,6-bis(1,1-dimethylethyl)-4-[[(4-hydroxyphenyl)imino]methyl]-
CAS No: 1620-82-2 Catalog No: AG001SLT MDL No:
Product Description
Catalog Number:
AG001SLT
Chemical Name:
Phenol, 2,6-bis(1,1-dimethylethyl)-4-[[(4-hydroxyphenyl)imino]methyl]-
CAS Number:
1620-82-2
Molecular Formula:
C21H27NO2
Molecular Weight:
325.4446
IUPAC Name:
2,6-ditert-butyl-4-[(4-hydroxyphenyl)iminomethyl]phenol
InChI:
InChI=1S/C21H27NO2/c1-20(2,3)17-11-14(12-18(19(17)24)21(4,5)6)13-22-15-7-9-16(23)10-8-15/h7-13,23-24H,1-6H3
InChI Key:
SIOFYSQLCFRELK-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)N=Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
Properties
Complexity:
400
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.204g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
325.452g/mol
Monoisotopic Mass:
325.204g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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