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17810-56-9

17810-56-9 | Hexadecanoic acid, 3-(hexadecyloxy)-2-hydroxypropyl ester

CAS No: 17810-56-9 Catalog No: AG0025RW MDL No:

Product Description

Catalog Number:
AG0025RW
Chemical Name:
Hexadecanoic acid, 3-(hexadecyloxy)-2-hydroxypropyl ester
CAS Number:
17810-56-9
Molecular Formula:
C35H70O4
Molecular Weight:
554.9279
IUPAC Name:
(3-hexadecoxy-2-hydroxypropyl) hexadecanoate
InChI:
InChI=1S/C35H70O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-38-32-34(36)33-39-35(37)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h34,36H,3-33H2,1-2H3
InChI Key:
NINHZDDYUBJLFZ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCOCC(COC(=O)CCCCCCCCCCCCCCC)O

Properties

Complexity:
468  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
554.527g/mol
Formal Charge:
0
Heavy Atom Count:
39  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
554.941g/mol
Monoisotopic Mass:
554.527g/mol
Rotatable Bond Count:
34  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
14.4  

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