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20914-87-8 | Propanimidic acid, 3-hydroxy-, ethyl ester
CAS No: 20914-87-8 Catalog No: AG002K31 MDL No:
Product Description
Catalog Number:
AG002K31
Chemical Name:
Propanimidic acid, 3-hydroxy-, ethyl ester
CAS Number:
20914-87-8
Molecular Formula:
C5H11NO2
Molecular Weight:
117.1463
IUPAC Name:
ethyl 3-hydroxypropanimidate
InChI:
InChI=1S/C5H11NO2/c1-2-8-5(6)3-4-7/h6-7H,2-4H2,1H3
InChI Key:
NDMUXLZJBJGOSS-UHFFFAOYSA-N
SMILES:
OCCC(=N)OCC
Properties
Complexity:
72.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
117.079g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
117.148g/mol
Monoisotopic Mass:
117.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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