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138538-28-0

138538-28-0 | Acetic acid, 2-[(13-hydroxytridecyl)oxy]-, ethyl ester

CAS No: 138538-28-0 Catalog No: AG0019EU MDL No:

Product Description

Catalog Number:
AG0019EU
Chemical Name:
Acetic acid, 2-[(13-hydroxytridecyl)oxy]-, ethyl ester
CAS Number:
138538-28-0
Molecular Formula:
C17H34O4
Molecular Weight:
302.4495
IUPAC Name:
ethyl 2-(13-hydroxytridecoxy)acetate
InChI:
InChI=1S/C17H34O4/c1-2-21-17(19)16-20-15-13-11-9-7-5-3-4-6-8-10-12-14-18/h18H,2-16H2,1H3
InChI Key:
IBPDENDMICXIHI-UHFFFAOYSA-N
SMILES:
OCCCCCCCCCCCCCOCC(=O)OCC

Properties

Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.246g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
302.455g/mol
Monoisotopic Mass:
302.246g/mol
Rotatable Bond Count:
17  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  

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