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102445-18-1

102445-18-1 | Phenol, 4,4'-nonylidenebis-

CAS No: 102445-18-1 Catalog No: AG0007IV MDL No:

Product Description

Catalog Number:
AG0007IV
Chemical Name:
Phenol, 4,4'-nonylidenebis-
CAS Number:
102445-18-1
Molecular Formula:
C21H28O2
Molecular Weight:
312.4458
IUPAC Name:
4-[1-(4-hydroxyphenyl)nonyl]phenol
InChI:
InChI=1S/C21H28O2/c1-2-3-4-5-6-7-8-21(17-9-13-19(22)14-10-17)18-11-15-20(23)16-12-18/h9-16,21-23H,2-8H2,1H3
InChI Key:
OUKOUEHLRVEKCJ-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(c1ccc(cc1)O)c1ccc(cc1)O

Properties

Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.209g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
312.453g/mol
Monoisotopic Mass:
312.209g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3  

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