1-Hydroxy-3-(piperidin-2-yl)-propane-1,1-diphosphonic acid

HCID 14231203
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Basic information

Standard SMILES
O=P(O)(O)C(O)(CCC1CCCCN1)P(=O)(O)O
InChIKey
ZEELUSNIWKDPLN-UHFFFAOYSA-N
Molecular formula
C8H19NO7P2
Average molar mass
303.19 g/mol

Names & identifiers

Preferred name
1-Hydroxy-3-(piperidin-2-yl)-propane-1,1-diphosphonic acid
IUPAC
(1-hydroxy-1-phosphono-3-piperidin-2-ylpropyl)phosphonic acid

Names & synonyms

SCHEMBL9084725ZEELUSNIWKDPLN-UHFFFAOYSA-N1-Hydroxy-3-(piperidin-2-yl)-propane-1,1-diphosphonic acid

Database identifiers

PubChem CID
14231203

Properties

Computed structural properties

XLogP
-5.1
Topological polar surface area
147 Ų
Hydrogen bond donors
6
Hydrogen bond acceptors
8
Rotatable bonds
5
Heavy atoms
18

Related reactions

1 records
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Linked notes

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