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123934-38-3 | 1-Undecanol, 11,11'-[1,2-phenylenebis(oxy)]bis- (9CI)
CAS No: 123934-38-3 Catalog No: AG000L8L MDL No:MFCD06656506
Product Description
Catalog Number:
AG000L8L
Chemical Name:
1-Undecanol, 11,11'-[1,2-phenylenebis(oxy)]bis- (9CI)
CAS Number:
123934-38-3
Molecular Formula:
C28H50O4
Molecular Weight:
450.6942
MDL Number:
MFCD06656506
IUPAC Name:
11-[2-(11-hydroxyundecoxy)phenoxy]undecan-1-ol
InChI:
InChI=1S/C28H50O4/c29-23-17-11-7-3-1-5-9-13-19-25-31-27-21-15-16-22-28(27)32-26-20-14-10-6-2-4-8-12-18-24-30/h15-16,21-22,29-30H,1-14,17-20,23-26H2
InChI Key:
YNWYVHHVZMGEQZ-UHFFFAOYSA-N
SMILES:
OCCCCCCCCCCCOc1ccccc1OCCCCCCCCCCCO
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
450.371g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
450.704g/mol
Monoisotopic Mass:
450.371g/mol
Rotatable Bond Count:
24
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.6
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