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15901-19-6 | Dodecanoic acid, 20-hydroxy-3,6,9,12,15,18-hexaoxaeicos-1-yl ester
CAS No: 15901-19-6 Catalog No: AG001QEF MDL No:
Product Description
Catalog Number:
AG001QEF
Chemical Name:
Dodecanoic acid, 20-hydroxy-3,6,9,12,15,18-hexaoxaeicos-1-yl ester
CAS Number:
15901-19-6
Molecular Formula:
C26H52O9
Molecular Weight:
508.6857
IUPAC Name:
2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl dodecanoate
InChI:
InChI=1S/C26H52O9/c1-2-3-4-5-6-7-8-9-10-11-26(28)35-25-24-34-23-22-33-21-20-32-19-18-31-17-16-30-15-14-29-13-12-27/h27H,2-25H2,1H3
InChI Key:
BQQKPNOCOGNCFY-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC(=O)OCCOCCOCCOCCOCCOCCOCCO
EC Number:
240-039-2
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
508.361g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
508.693g/mol
Monoisotopic Mass:
508.361g/mol
Rotatable Bond Count:
31
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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