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1330-61-6 | 2-Propenoic acid, isodecyl ester
CAS No: 1330-61-6 Catalog No: AG0011HX MDL No:MFCD00080455
Product Description
Catalog Number:
AG0011HX
Chemical Name:
2-Propenoic acid, isodecyl ester
CAS Number:
1330-61-6
Molecular Formula:
C13H24O2
Molecular Weight:
212.3285
MDL Number:
MFCD00080455
IUPAC Name:
8-methylnonyl prop-2-enoate
InChI:
InChI=1S/C13H24O2/c1-4-13(14)15-11-9-7-5-6-8-10-12(2)3/h4,12H,1,5-11H2,2-3H3
InChI Key:
LVGFPWDANALGOY-UHFFFAOYSA-N
SMILES:
C=CC(=O)OCCCCCCCC(C)C
EC Number:
215-542-5
UNII:
WET3U98PW2
UN Number:
3082
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.178g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.333g/mol
Monoisotopic Mass:
212.178g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
Literature
| Title | Journal |
|---|---|
| FTIR-ATR study of water uptake and diffusion through ion-selective membranes based on poly(acrylates) and silicone rubber. | Analytical chemistry 20090715 |
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