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13149-86-5 | 3,6,9,12,15,18,21,24,27,30-Decaoxaoctatetracontan-1-ol
CAS No: 13149-86-5 Catalog No: AG000WAZ MDL No:
Product Description
Catalog Number:
AG000WAZ
Chemical Name:
3,6,9,12,15,18,21,24,27,30-Decaoxaoctatetracontan-1-ol
CAS Number:
13149-86-5
Molecular Formula:
C38H78O11
Molecular Weight:
711.0193
IUPAC Name:
2-[2-[2-[2-[2-[2-[2-[2-[2-(2-octadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
InChI:
InChI=1S/C38H78O11/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-40-21-23-42-25-27-44-29-31-46-33-35-48-37-38-49-36-34-47-32-30-45-28-26-43-24-22-41-20-18-39/h39H,2-38H2,1H3
InChI Key:
HNUQMTZUNUBOLQ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
Properties
Complexity:
560
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
710.554g/mol
Formal Charge:
0
Heavy Atom Count:
49
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
711.031g/mol
Monoisotopic Mass:
710.554g/mol
Rotatable Bond Count:
46
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7
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