
 CID 10466077

 34 34  0  0  0  0  0  0  0  0999 V2000
   -3.5910   -1.5322   -1.8742 C   0  0  0  0  0
   -3.2290   -1.1168   -3.2958 C   0  0  0  0  0
   -1.9915   -0.2343   -3.2841 C   0  0  0  0  0
   -0.8946   -0.9214   -2.6779 O   0  0  0  0  0
   -1.1424   -1.2457   -1.2985 C   0  0  0  0  0
   -2.3820   -2.1406   -1.1732 C   0  0  0  0  0
    0.0860   -1.9782   -0.7666 C   0  0  0  0  0
    1.5692   -0.9880   -0.8305 P   0  0  0  0  0
    1.4966    0.3071   -0.0792 O   0  0  0  0  0
    2.9597   -2.0334   -0.4341 C   0  0  0  0  0
    2.9351   -2.7454    0.9122 C   0  0  0  0  0
    3.0943   -1.8277    2.1216 C   0  0  0  0  0
    1.8981   -1.0366    2.3727 N   0  0  0  0  0
    1.7684   -0.7359   -2.4153 O   0  0  0  0  0
   -3.9378   -0.6561   -1.3141 H   0  0  0  0  0
   -4.4158   -2.2529   -1.8922 H   0  0  0  0  0
   -4.0694   -0.5957   -3.7655 H   0  0  0  0  0
   -3.0244   -2.0193   -3.8847 H   0  0  0  0  0
   -1.7006    0.0132   -4.3097 H   0  0  0  0  0
   -2.1726    0.7068   -2.7534 H   0  0  0  0  0
   -1.2834   -0.3099   -0.7434 H   0  0  0  0  0
   -2.1761   -3.1148   -1.6358 H   0  0  0  0  0
   -2.6151   -2.3250   -0.1184 H   0  0  0  0  0
    0.2658   -2.8863   -1.3544 H   0  0  0  0  0
   -0.0893   -2.2841    0.2707 H   0  0  0  0  0
    3.8785   -1.4427   -0.5235 H   0  0  0  0  0
    3.0137   -2.8036   -1.2127 H   0  0  0  0  0
    3.7609   -3.4668    0.9268 H   0  0  0  0  0
    2.0133   -3.3308    1.0072 H   0  0  0  0  0
    3.9636   -1.1714    2.0000 H   0  0  0  0  0
    3.2802   -2.4494    3.0061 H   0  0  0  0  0
    1.8124   -0.2977    1.6560 H   0  0  0  0  0
    2.0237   -0.5130    3.2395 H   0  0  0  0  0
    0.9421   -0.4086   -2.8412 H   0  0  0  0  0
  1  6  1  0  0  0
  1  2  1  0  0  0
  1 15  1  0  0  0
  1 16  1  0  0  0
  2  3  1  0  0  0
  2 17  1  0  0  0
  2 18  1  0  0  0
  3  4  1  0  0  0
  3 19  1  0  0  0
  3 20  1  0  0  0
  4  5  1  0  0  0
  5  6  1  0  0  0
  5  7  1  0  0  0
  5 21  1  0  0  0
  6 22  1  0  0  0
  6 23  1  0  0  0
  7  8  1  0  0  0
  7 24  1  0  0  0
  7 25  1  0  0  0
  8 14  1  0  0  0
  8 10  1  0  0  0
  8  9  2  0  0  0
 10 11  1  0  0  0
 10 26  1  0  0  0
 10 27  1  0  0  0
 11 12  1  0  0  0
 11 28  1  0  0  0
 11 29  1  0  0  0
 12 13  1  0  0  0
 12 30  1  0  0  0
 12 31  1  0  0  0
 13 32  1  0  0  0
 13 33  1  0  0  0
 14 34  1  0  0  0
M  END

>  <Chemical Name>
CID 10466077

>  <PubChem CID>
10466077

>  <Formula>
C9H20NO3P

>  <Molecular Weight>
221.237000

>  <IUPAC Name>
3-aminopropyl(oxan-2-ylmethyl)phosphinic acid

>  <XlogP>
-3.2

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1CCOC(C1)CP(=O)(CCCN)O

>  <Isomeric SMILES>
C1CCOC(C1)CP(=O)(CCCN)O

>  <InChI Std. ID>
InChI=1S/C9H20NO3P/c10-5-3-7-14(11,12)8-9-4-1-2-6-13-9/h9H,1-8,10H2,(H,11,12)

>  <InChI Key>
MJMQTOVUFULNKO-UHFFFAOYSA-N

