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88606-76-2 | Decanoic acid, 2,3-dichloropropyl ester
CAS No: 88606-76-2 Catalog No: AG004CBC MDL No:
Product Description
Catalog Number:
AG004CBC
Chemical Name:
Decanoic acid, 2,3-dichloropropyl ester
CAS Number:
88606-76-2
Molecular Formula:
C13H24Cl2O2
Molecular Weight:
283.2345
IUPAC Name:
2,3-dichloropropyl decanoate
InChI:
InChI=1S/C13H24Cl2O2/c1-2-3-4-5-6-7-8-9-13(16)17-11-12(15)10-14/h12H,2-11H2,1H3
InChI Key:
KCEHDHNCSNRRCL-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC(=O)OCC(CCl)Cl
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.115g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.233g/mol
Monoisotopic Mass:
282.115g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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