CID 170843971

C8H19K2O4P — CID 170843971

IUPAC—
SMILESCCCCCCCCOP(=O)(O)O.[K].[K]
InChIInChI=1S/C8H19O4P.2K/c1-2-3-4-5-6-7-8-12-13(9,10)11;;/h2-8H2,1H3,(H2,9,10,11);;
InChIKeySQEKEJVXOKDSCP-UHFFFAOYSA-N
MW288.41 g/mol
LogP1.69
Rot. Bonds8

About CID 170843971

CID 170843971 (PubChem CID 170843971) has the molecular formula C8H19K2O4P and a molecular weight of 288.41 g/mol.

Molecular Properties

Compound NameCID 170843971
PubChem CID170843971
Molecular FormulaC8H19K2O4P
Molecular Weight288.41 g/mol
Exact Mass288.03
IUPAC Name—
SMILESCCCCCCCCOP(=O)(O)O.[K].[K]
InChIInChI=1S/C8H19O4P.2K/c1-2-3-4-5-6-7-8-12-13(9,10)11;;/h2-8H2,1H3,(H2,9,10,11);;
InChIKeySQEKEJVXOKDSCP-UHFFFAOYSA-N
XLogP1.69
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.41
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

CID 170842594
CID 170842594
octatriacontyl dihydrogen phosphate
CID 140979287
heptyl dihydrogen phosphate;octyl dihydrogen phosphate
CID 160757103
pentatriacontyl dihydrogen phosphate
CID 164897229
hexadecyl dihydrogen phosphate;tetradecyl dihydrogen phosphate
CID 159430233
azane;octadecyl dihydrogen phosphate
CID 87905459
dodecyl dihydrogen phosphate;indigane
CID 173026750
hexyl dihydrogen phosphate;neodymium
CID 174801976
iron;octadecyl dihydrogen phosphate
CID 175059517
alumane;tridecyl dihydrogen phosphate
CID 173322009
ethanol;hexadecyl dihydrogen phosphate
CID 174523308
sodium;hydride;tetradecyl dihydrogen phosphate
CID 173022959

Frequently Asked Questions

What is the IUPAC name of CID 170843971?
The IUPAC name of CID 170843971 (CID 170843971) is not available.
What is the SMILES notation for CID 170843971?
The canonical SMILES for CID 170843971 is CCCCCCCCOP(=O)(O)O.[K].[K].
What is the InChIKey of CID 170843971?
The InChIKey is SQEKEJVXOKDSCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19O4P.2K/c1-2-3-4-5-6-7-8-12-13(9,10)11;;/h2-8H2,1H3,(H2,9,10,11);;.
What are the key properties of CID 170843971?
CID 170843971 has a molecular weight of 288.41 g/mol, XLogP of 1.69, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 170843971 is sourced from PubChem (CID 170843971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).