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116770-34-4 | 2-Propenoic acid, 2-methyl-, 2-[(methoxycarbonyl)oxy]ethyl ester
CAS No: 116770-34-4 Catalog No: AG000D7D MDL No:
Product Description
Catalog Number:
AG000D7D
Chemical Name:
2-Propenoic acid, 2-methyl-, 2-[(methoxycarbonyl)oxy]ethyl ester
CAS Number:
116770-34-4
Molecular Formula:
C8H12O5
Molecular Weight:
188.1779
IUPAC Name:
2-methoxycarbonyloxyethyl 2-methylprop-2-enoate
InChI:
InChI=1S/C8H12O5/c1-6(2)7(9)12-4-5-13-8(10)11-3/h1,4-5H2,2-3H3
InChI Key:
KOXTUPRIBYBHLV-UHFFFAOYSA-N
SMILES:
COC(=O)OCCOC(=O)C(=C)C
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.068g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.179g/mol
Monoisotopic Mass:
188.068g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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