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86278-81-1 | 2-Propenoic acid, 3-(2-methyl-1,3-dioxolan-2-yl)-, ethyl ester
CAS No: 86278-81-1 Catalog No: AG004MTM MDL No:
Product Description
Catalog Number:
AG004MTM
Chemical Name:
2-Propenoic acid, 3-(2-methyl-1,3-dioxolan-2-yl)-, ethyl ester
CAS Number:
86278-81-1
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
IUPAC Name:
ethyl 3-(2-methyl-1,3-dioxolan-2-yl)prop-2-enoate
InChI:
InChI=1S/C9H14O4/c1-3-11-8(10)4-5-9(2)12-6-7-13-9/h4-5H,3,6-7H2,1-2H3
InChI Key:
BAEAEMTZZZYEQD-UHFFFAOYSA-N
SMILES:
CCOC(=O)C=CC1(C)OCCO1
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.089g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.207g/mol
Monoisotopic Mass:
186.089g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.5
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