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208995-96-4 | [1,1'-Biphenyl]-4-ol, 4'-(octadecyloxy)-
CAS No: 208995-96-4 Catalog No: AG002JZP MDL No:
Product Description
Catalog Number:
AG002JZP
Chemical Name:
[1,1'-Biphenyl]-4-ol, 4'-(octadecyloxy)-
CAS Number:
208995-96-4
Molecular Formula:
C30H46O2
Molecular Weight:
438.6850
IUPAC Name:
4-(4-octadecoxyphenyl)phenol
InChI:
InChI=1S/C30H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26-32-30-24-20-28(21-25-30)27-18-22-29(31)23-19-27/h18-25,31H,2-17,26H2,1H3
InChI Key:
CNWVQFXDSFASPQ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCOc1ccc(cc1)c1ccc(cc1)O
Properties
Complexity:
394
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
438.35g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
438.696g/mol
Monoisotopic Mass:
438.35g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
12.1
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