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88973-03-9 | Phenol, 2,6-bis(1,1-dimethylethyl)-4-imidazo[1,2-a]pyridin-2-yl-
CAS No: 88973-03-9 Catalog No: AG0045BV MDL No:
Product Description
Catalog Number:
AG0045BV
Chemical Name:
Phenol, 2,6-bis(1,1-dimethylethyl)-4-imidazo[1,2-a]pyridin-2-yl-
CAS Number:
88973-03-9
Molecular Formula:
C21H26N2O
Molecular Weight:
322.4439
IUPAC Name:
2,6-ditert-butyl-4-imidazo[1,2-a]pyridin-2-ylphenol
InChI:
InChI=1S/C21H26N2O/c1-20(2,3)15-11-14(12-16(19(15)24)21(4,5)6)17-13-23-10-8-7-9-18(23)22-17/h7-13,24H,1-6H3
InChI Key:
ZJMKPPOKEMOCMT-UHFFFAOYSA-N
SMILES:
Oc1c(cc(cc1C(C)(C)C)c1nc2n(c1)cccc2)C(C)(C)C
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.205g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
322.452g/mol
Monoisotopic Mass:
322.205g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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