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77402-03-0 | Acetic acid,2-methoxy-2-[(1-oxo-2-propen-1-yl)amino]-, methyl ester
CAS No: 77402-03-0 Catalog No: AG0053SG MDL No:
Product Description
Catalog Number:
AG0053SG
Chemical Name:
Acetic acid,2-methoxy-2-[(1-oxo-2-propen-1-yl)amino]-, methyl ester
CAS Number:
77402-03-0
Molecular Formula:
C7H11NO4
Molecular Weight:
173.1665
IUPAC Name:
methyl 2-methoxy-2-(prop-2-enoylamino)acetate
InChI:
InChI=1S/C7H11NO4/c1-4-5(9)8-6(11-2)7(10)12-3/h4,6H,1H2,2-3H3,(H,8,9)
InChI Key:
JMSTYCQEPRPFBF-UHFFFAOYSA-N
SMILES:
C=CC(=O)NC(C(=O)OC)OC
EC Number:
401-890-7
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.069g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.168g/mol
Monoisotopic Mass:
173.069g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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