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144230-27-3 | Phosphonic acid, [(4-hydroxy-1-piperidinyl)methylene]bis- (9CI)
CAS No: 144230-27-3 Catalog No: AG001J5J MDL No:
Product Description
Catalog Number:
AG001J5J
Chemical Name:
Phosphonic acid, [(4-hydroxy-1-piperidinyl)methylene]bis- (9CI)
CAS Number:
144230-27-3
Molecular Formula:
C6H15NO7P2
Molecular Weight:
275.1333
IUPAC Name:
[(4-hydroxypiperidin-1-yl)-phosphonomethyl]phosphonic acid
InChI:
InChI=1S/C6H15NO7P2/c8-5-1-3-7(4-2-5)6(15(9,10)11)16(12,13)14/h5-6,8H,1-4H2,(H2,9,10,11)(H2,12,13,14)
InChI Key:
MDCNNIRRNBNADF-UHFFFAOYSA-N
SMILES:
OC1CCN(CC1)C(P(=O)(O)O)P(=O)(O)O
NSC Number:
723976
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.032g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
275.134g/mol
Monoisotopic Mass:
275.032g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
139A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-5.5
Literature
| Title | Journal |
|---|---|
| Effects of bisphosphonates on the growth of Entamoeba histolytica and Plasmodium species in vitro and in vivo. | Journal of medicinal chemistry 20040101 |
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