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146515-28-8 | Decanoic acid, 4-oxo-2-(2-propen-1-yl)-, methyl ester
CAS No: 146515-28-8 Catalog No: AG001E3L MDL No:
Product Description
Catalog Number:
AG001E3L
Chemical Name:
Decanoic acid, 4-oxo-2-(2-propen-1-yl)-, methyl ester
CAS Number:
146515-28-8
Molecular Formula:
C14H24O3
Molecular Weight:
240.3386
IUPAC Name:
methyl 4-oxo-2-prop-2-enyldecanoate
InChI:
InChI=1S/C14H24O3/c1-4-6-7-8-10-13(15)11-12(9-5-2)14(16)17-3/h5,12H,2,4,6-11H2,1,3H3
InChI Key:
WAFFARMZIKCLHF-UHFFFAOYSA-N
SMILES:
CCCCCCC(=O)CC(C(=O)OC)CC=C
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.173g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.343g/mol
Monoisotopic Mass:
240.173g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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