lithium fluoro hexyl phosphate

C6H13FLiO4P — CID 23706071

IUPAClithium fluoro hexyl phosphate
SMILESCCCCCCOP(=O)([O-])OF.[Li+]
InChIInChI=1S/C6H14FO4P.Li/c1-2-3-4-5-6-10-12(8,9)11-7;/h2-6H2,1H3,(H,8,9);/q;+1/p-1
InChIKeyFIQIGTLWAFXVLP-UHFFFAOYSA-M
MW206.08 g/mol
LogP-1.04
Rot. Bonds7

About lithium fluoro hexyl phosphate

lithium fluoro hexyl phosphate (PubChem CID 23706071) has the molecular formula C6H13FLiO4P and a molecular weight of 206.08 g/mol. Its IUPAC name is lithium fluoro hexyl phosphate.

Molecular Properties

Compound Namelithium fluoro hexyl phosphate
PubChem CID23706071
Molecular FormulaC6H13FLiO4P
Molecular Weight206.08 g/mol
Exact Mass206.07
IUPAC Namelithium fluoro hexyl phosphate
SMILESCCCCCCOP(=O)([O-])OF.[Li+]
InChIInChI=1S/C6H14FO4P.Li/c1-2-3-4-5-6-10-12(8,9)11-7;/h2-6H2,1H3,(H,8,9);/q;+1/p-1
InChIKeyFIQIGTLWAFXVLP-UHFFFAOYSA-M
XLogP-1.04
TPSA58.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.08
LogP ≤ 5-1.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

diicosyl phosphate
CID 21219883
disodium bis(dioctadecyl phosphate)
CID 172826116
zinc bis(dinonyl phosphate)
CID 87237924
dilithium;tetradecyl phosphate
CID 139820221
beryllium bis(dihexadecyl phosphate)
CID 102241208
chromium(2+);dihexyl phosphate
CID 18626712
azanium didecyl phosphate
CID 157179907
2-[decoxy(oxido)phosphoryl]oxyethyl decyl phosphate
CID 102130313
dilithium;tridecyl phosphate
CID 159999815
potassium dodecyl octyl phosphate
CID 175269895
calcium bis(dihexyl phosphate)
CID 159957382
dilithium;octacosyl phosphate
CID 139820226

Frequently Asked Questions

What is the IUPAC name of lithium fluoro hexyl phosphate?
The IUPAC name of lithium fluoro hexyl phosphate (CID 23706071) is lithium fluoro hexyl phosphate.
What is the SMILES notation for lithium fluoro hexyl phosphate?
The canonical SMILES for lithium fluoro hexyl phosphate is CCCCCCOP(=O)([O-])OF.[Li+].
What is the InChIKey of lithium fluoro hexyl phosphate?
The InChIKey is FIQIGTLWAFXVLP-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H14FO4P.Li/c1-2-3-4-5-6-10-12(8,9)11-7;/h2-6H2,1H3,(H,8,9);/q;+1/p-1.
What are the key properties of lithium fluoro hexyl phosphate?
lithium fluoro hexyl phosphate has a molecular weight of 206.08 g/mol, XLogP of -1.04, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for lithium fluoro hexyl phosphate is sourced from PubChem (CID 23706071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).