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17330-09-5 | Phenol, 2,6-bis(1,1-dimethylethyl)-4-(phenyl-1-piperidinylmethyl)-
CAS No: 17330-09-5 Catalog No: AG001YS1 MDL No:
Product Description
Catalog Number:
AG001YS1
Chemical Name:
Phenol, 2,6-bis(1,1-dimethylethyl)-4-(phenyl-1-piperidinylmethyl)-
CAS Number:
17330-09-5
Molecular Formula:
C26H37NO
Molecular Weight:
379.5781
IUPAC Name:
2,6-ditert-butyl-4-[phenyl(piperidin-1-yl)methyl]phenol
InChI:
InChI=1S/C26H37NO/c1-25(2,3)21-17-20(18-22(24(21)28)26(4,5)6)23(19-13-9-7-10-14-19)27-15-11-8-12-16-27/h7,9-10,13-14,17-18,23,28H,8,11-12,15-16H2,1-6H3
InChI Key:
CKEXYVSMAAJUCU-UHFFFAOYSA-N
SMILES:
CC(c1cc(cc(c1O)C(C)(C)C)C(c1ccccc1)N1CCCCC1)(C)C
Properties
Complexity:
452
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.288g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
379.588g/mol
Monoisotopic Mass:
379.288g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3
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