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14529-40-9 | 3,6,9,12,15,18,21,24,27,30-Decaoxahexatetracontan-1-ol
CAS No: 14529-40-9 Catalog No: AG001KRO MDL No:
Product Description
Catalog Number:
AG001KRO
Chemical Name:
3,6,9,12,15,18,21,24,27,30-Decaoxahexatetracontan-1-ol
CAS Number:
14529-40-9
Molecular Formula:
C36H74O11
Molecular Weight:
682.9662
IUPAC Name:
2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hexadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
InChI:
InChI=1S/C36H74O11/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-38-19-21-40-23-25-42-27-29-44-31-33-46-35-36-47-34-32-45-30-28-43-26-24-41-22-20-39-18-16-37/h37H,2-36H2,1H3
InChI Key:
ZWINLZAYDMUOAE-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
Properties
Complexity:
531
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
682.523g/mol
Formal Charge:
0
Heavy Atom Count:
47
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
682.977g/mol
Monoisotopic Mass:
682.523g/mol
Rotatable Bond Count:
44
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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