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102376-29-4

102376-29-4 | Octadecanoyl chloride, 12-(acetyloxy)-

CAS No: 102376-29-4 Catalog No: AG0007AB MDL No:

Product Description

Catalog Number:
AG0007AB
Chemical Name:
Octadecanoyl chloride, 12-(acetyloxy)-
CAS Number:
102376-29-4
Molecular Formula:
C20H37ClO3
Molecular Weight:
360.9590
IUPAC Name:
(18-chloro-18-oxooctadecan-7-yl) acetate
InChI:
InChI=1S/C20H37ClO3/c1-3-4-5-12-15-19(24-18(2)22)16-13-10-8-6-7-9-11-14-17-20(21)23/h19H,3-17H2,1-2H3
InChI Key:
LONVWVYQLLBTBG-UHFFFAOYSA-N
SMILES:
CCCCCCC(OC(=O)C)CCCCCCCCCCC(=O)Cl

Properties

Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.243g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
360.963g/mol
Monoisotopic Mass:
360.243g/mol
Rotatable Bond Count:
18  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
7.9  

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