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115914-44-8 | Phenol, 4,4'-(1,14-tetradecanediyl)bis-
CAS No: 115914-44-8 Catalog No: AG000H3E MDL No:
Product Description
Catalog Number:
AG000H3E
Chemical Name:
Phenol, 4,4'-(1,14-tetradecanediyl)bis-
CAS Number:
115914-44-8
Molecular Formula:
C26H38O2
Molecular Weight:
382.5787
IUPAC Name:
4-[14-(4-hydroxyphenyl)tetradecyl]phenol
InChI:
InChI=1S/C26H38O2/c27-25-19-15-23(16-20-25)13-11-9-7-5-3-1-2-4-6-8-10-12-14-24-17-21-26(28)22-18-24/h15-22,27-28H,1-14H2
InChI Key:
VDTVBSPVMZIGMV-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)CCCCCCCCCCCCCCc1ccc(cc1)O
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.287g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
382.588g/mol
Monoisotopic Mass:
382.287g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.7
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