
 2-azaniumylacetate

 10  9  0  0  0  0  0  0  0  0999 V2000
    0.8741   -0.0118    0.1260 C   0  0  0  0  0
    0.2274    0.4843   -1.1887 C   0  0  0  0  0
   -1.0140    0.6016   -1.2089 O   0  0  0  0  0
    1.1439    0.7051   -2.0492 O   0  0  0  0  0
    2.3801    0.0457   -0.0115 N   0  0  0  0  0
    2.8559   -0.8382    0.1589 H   0  0  0  0  0
    2.4585    0.2656   -1.0399 H   0  0  0  0  0
    2.7906    0.8475    0.4668 H   0  0  0  0  0
    0.6053    0.6170    0.9780 H   0  0  0  0  0
    0.6141   -1.0568    0.3128 H   0  0  0  0  0
  1  5  1  0  0  0
  1  2  1  0  0  0
  1  9  1  0  0  0
  1 10  1  0  0  0
  2  4  1  0  0  0
  2  3  2  0  0  0
  5  8  1  0  0  0
  5  7  1  0  0  0
  5  6  1  0  0  0
M  CHG  2   4  -1   5   1
M  END

>  <Chemical Name>
2-azaniumylacetate

>  <PubChem CID>
5257127

>  <Formula>
C2H5NO2

>  <Molecular Weight>
75.067000

>  <IUPAC Name>
2-azaniumylacetate

>  <XlogP>
-2.8

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
C(C(=O)[O-])[NH3+]

>  <Isomeric SMILES>
C(C(=O)[O-])[NH3+]

>  <InChI Std. ID>
InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)

>  <InChI Key>
DHMQDGOQFOQNFH-UHFFFAOYSA-N

