Home Other Building Blocks Octanoic acid,1,1'-[1,2-ethanediylbis(oxy-2,1-ethanediyl)] ester

Octanoic acid,1,1'-[1,2-ethanediylbis(oxy-2,1-ethanediyl)] ester

CAS No.:
106-10-5
Catalog Number:
AG0084DS
Molecular Formula:
C22H46O8
Molecular Weight:
438.5958
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Product Description
Catalog Number:
AG0084DS
Chemical Name:
Octanoic acid,1,1'-[1,2-ethanediylbis(oxy-2,1-ethanediyl)] ester
CAS Number:
106-10-5
Molecular Formula:
C22H46O8
Molecular Weight:
438.5958
IUPAC Name:
2-[2-(2-octanoyloxyethoxy)ethoxy]ethyl octanoate
InChI:
InChI=1S/C22H42O6/c1-3-5-7-9-11-13-21(23)27-19-17-25-15-16-26-18-20-28-22(24)14-12-10-8-6-4-2/h3-20H2,1-2H3
InChI Key:
YJGHMLJGPSVSLF-UHFFFAOYSA-N
SMILES:
CCCCCCCC(=O)O.CCCCCCCC(=O)O.OCCOCCOCCO
EC Number:
203-361-4
NSC Number:
6380
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
402.298g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
402.572g/mol
Monoisotopic Mass:
402.298g/mol
Rotatable Bond Count:
23  
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7  
Properties