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21045-69-2 | 2-Propenoic acid, 2-methoxy-2-oxoethyl ester
CAS No: 21045-69-2 Catalog No: AG002KSZ MDL No:
Product Description
Catalog Number:
AG002KSZ
Chemical Name:
2-Propenoic acid, 2-methoxy-2-oxoethyl ester
CAS Number:
21045-69-2
Molecular Formula:
C6H8O4
Molecular Weight:
144.1253
IUPAC Name:
(2-methoxy-2-oxoethyl) prop-2-enoate
InChI:
InChI=1S/C6H8O4/c1-3-5(7)10-4-6(8)9-2/h3H,1,4H2,2H3
InChI Key:
AAXGLZUUHYACNA-UHFFFAOYSA-N
SMILES:
COC(=O)COC(=O)C=C
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.042g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.126g/mol
Monoisotopic Mass:
144.042g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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