
 (Aminomethyl)(3-aminopropyl)phosphinic acid

 22 21  0  0  0  0  0  0  0  0999 V2000
    1.1349    0.0064    0.0202 C   0  0  0  0  0
    0.3488    0.2443   -1.2706 C   0  0  0  0  0
    0.2837    1.6605   -1.6374 N   0  0  0  0  0
    2.6357    0.2639   -0.0924 C   0  0  0  0  0
    3.1294    1.9761   -0.2554 P   0  0  0  0  0
    2.4396    2.9048    0.7008 O   0  0  0  0  0
    4.9269    2.0422   -0.2140 C   0  0  0  0  0
    5.3981    1.2983   -1.3936 N   0  0  0  0  0
    2.7842    2.3391   -1.7963 O   0  0  0  0  0
    0.7153    0.6162    0.8288 H   0  0  0  0  0
    0.9916   -1.0415    0.3111 H   0  0  0  0  0
   -0.6735   -0.1285   -1.1370 H   0  0  0  0  0
    0.7972   -0.3196   -2.0961 H   0  0  0  0  0
   -0.1026    2.1837   -0.8406 H   0  0  0  0  0
   -0.4196    1.7660   -2.3755 H   0  0  0  0  0
    3.0523   -0.3239   -0.9179 H   0  0  0  0  0
    3.1063   -0.1110    0.8238 H   0  0  0  0  0
    5.3223    1.5981    0.7033 H   0  0  0  0  0
    5.2546    3.0834   -0.2817 H   0  0  0  0  0
    4.8540    1.6407   -2.1964 H   0  0  0  0  0
    6.3639    1.5618   -1.5864 H   0  0  0  0  0
    1.8058    2.2396   -1.9475 H   0  0  0  0  0
  1  4  1  0  0  0
  1  2  1  0  0  0
  1 10  1  0  0  0
  1 11  1  0  0  0
  2  3  1  0  0  0
  2 12  1  0  0  0
  2 13  1  0  0  0
  3 14  1  0  0  0
  3 15  1  0  0  0
  4  5  1  0  0  0
  4 16  1  0  0  0
  4 17  1  0  0  0
  5  9  1  0  0  0
  5  7  1  0  0  0
  5  6  2  0  0  0
  7  8  1  0  0  0
  7 18  1  0  0  0
  7 19  1  0  0  0
  8 20  1  0  0  0
  8 21  1  0  0  0
  9 22  1  0  0  0
M  END

>  <Chemical Name>
(Aminomethyl)(3-aminopropyl)phosphinic acid

>  <PubChem CID>
15134810

>  <Formula>
C4H13N2O2P

>  <Molecular Weight>
152.134000

>  <IUPAC Name>
aminomethyl(3-aminopropyl)phosphinic acid

>  <XlogP>
-4.8

>  <Hydrogen Bond Donors>
3

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C(CN)CP(=O)(CN)O

>  <Isomeric SMILES>
C(CN)CP(=O)(CN)O

>  <InChI Std. ID>
InChI=1S/C4H13N2O2P/c5-2-1-3-9(7,8)4-6/h1-6H2,(H,7,8)

>  <InChI Key>
OXYYFALHJULFJL-UHFFFAOYSA-N

