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876275-54-6 | Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-(octadecylamino)propyl]-
CAS No: 876275-54-6 Catalog No: AG004HVY MDL No:
Product Description
Catalog Number:
AG004HVY
Chemical Name:
Phenol, 2,6-bis(1,1-dimethylethyl)-4-[3-(octadecylamino)propyl]-
CAS Number:
876275-54-6
Molecular Formula:
C35H65NO
Molecular Weight:
515.8967
IUPAC Name:
2,6-ditert-butyl-4-[3-(octadecylamino)propyl]phenol
InChI:
InChI=1S/C35H65NO/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-36-27-24-25-30-28-31(34(2,3)4)33(37)32(29-30)35(5,6)7/h28-29,36-37H,8-27H2,1-7H3
InChI Key:
AAKWQXRQQGZASC-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCNCCCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
Properties
Complexity:
492
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
515.507g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
515.911g/mol
Monoisotopic Mass:
515.507g/mol
Rotatable Bond Count:
23
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
13.9
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