Home Halogens Hexadecanoic acid, 3-chloro-2-hydroxypropyl ester

Hexadecanoic acid, 3-chloro-2-hydroxypropyl ester

CAS No.:
30557-04-1
Catalog Number:
AG0030JN
Molecular Formula:
C19H37ClO3
Molecular Weight:
348.9483
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Product Description
Catalog Number:
AG0030JN
Chemical Name:
Hexadecanoic acid, 3-chloro-2-hydroxypropyl ester
CAS Number:
30557-04-1
Molecular Formula:
C19H37ClO3
Molecular Weight:
348.9483
MDL Number:
MFCD07369625
IUPAC Name:
(3-chloro-2-hydroxypropyl) hexadecanoate
InChI:
InChI=1S/C19H37ClO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-17-18(21)16-20/h18,21H,2-17H2,1H3
InChI Key:
CHBIHFLJUKBYRJ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCC(=O)OCC(CCl)O
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.243g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
348.952g/mol
Monoisotopic Mass:
348.243g/mol
Rotatable Bond Count:
18  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4  
Properties