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877433-28-8 | Phenol, 5-sec-octyl-2-(phenylamino)-
CAS No: 877433-28-8 Catalog No: AG004FM6 MDL No:
Product Description
Catalog Number:
AG004FM6
Chemical Name:
Phenol, 5-sec-octyl-2-(phenylamino)-
CAS Number:
877433-28-8
Molecular Formula:
C20H27NO
Molecular Weight:
297.4345
IUPAC Name:
2-anilino-5-octan-2-ylphenol
InChI:
InChI=1S/C20H27NO/c1-3-4-5-7-10-16(2)17-13-14-19(20(22)15-17)21-18-11-8-6-9-12-18/h6,8-9,11-16,21-22H,3-5,7,10H2,1-2H3
InChI Key:
VLYZQHGKVREXAT-UHFFFAOYSA-N
SMILES:
CCCCCCC(c1ccc(c(c1)O)Nc1ccccc1)C
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.209g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
297.442g/mol
Monoisotopic Mass:
297.209g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
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