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161764-82-5 | Benzenemethanol, 2-hydroxy-6-(8Z)-8-pentadecen-1-yl-
CAS No: 161764-82-5 Catalog No: AG001VVD MDL No:
Product Description
Catalog Number:
AG001VVD
Chemical Name:
Benzenemethanol, 2-hydroxy-6-(8Z)-8-pentadecen-1-yl-
CAS Number:
161764-82-5
Molecular Formula:
C22H36O2
Molecular Weight:
332.5200
IUPAC Name:
2-(hydroxymethyl)-3-pentadec-8-enylphenol
InChI:
InChI=1S/C22H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-20-17-15-18-22(24)21(20)19-23/h7-8,15,17-18,23-24H,2-6,9-14,16,19H2,1H3
InChI Key:
CPBKJXNFGQXDBN-UHFFFAOYSA-N
SMILES:
CCCCCC/C=C\CCCCCCCc1cccc(c1CO)O
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.272g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
332.528g/mol
Monoisotopic Mass:
332.272g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
8.1
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