dilithium;tetradecyl phosphate

C14H29Li2O4P — CID 139820221

IUPACdilithium;tetradecyl phosphate
SMILESCCCCCCCCCCCCCCOP(=O)([O-])[O-].[Li+].[Li+]
InChIInChI=1S/C14H31O4P.2Li/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-19(15,16)17;;/h2-14H2,1H3,(H2,15,16,17);;/q;2*+1/p-2
InChIKeyGZWRFEXIVNSPIB-UHFFFAOYSA-L
MW306.24 g/mol
LogP-2.46
Rot. Bonds14

About dilithium;tetradecyl phosphate

dilithium;tetradecyl phosphate (PubChem CID 139820221) has the molecular formula C14H29Li2O4P and a molecular weight of 306.24 g/mol. Its IUPAC name is dilithium;tetradecyl phosphate.

Molecular Properties

Compound Namedilithium;tetradecyl phosphate
PubChem CID139820221
Molecular FormulaC14H29Li2O4P
Molecular Weight306.24 g/mol
Exact Mass306.21
IUPAC Namedilithium;tetradecyl phosphate
SMILESCCCCCCCCCCCCCCOP(=O)([O-])[O-].[Li+].[Li+]
InChIInChI=1S/C14H31O4P.2Li/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-19(15,16)17;;/h2-14H2,1H3,(H2,15,16,17);;/q;2*+1/p-2
InChIKeyGZWRFEXIVNSPIB-UHFFFAOYSA-L
XLogP-2.46
TPSA72.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.24
LogP ≤ 5-2.46
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'}

Analyze dilithium;tetradecyl phosphate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

dilithium;tridecyl phosphate
CID 159999815
dilithium;octacosyl phosphate
CID 139820226
calcium hexadecyl phosphate
CID 15662538
disodium;zinc;bis(hexadecyl phosphate)
CID 71736811
calcium dotriacontyl phosphate
CID 164901019
calcium tetradecyl phosphate
CID 172742428
aluminum nonyl phosphate
CID 19089706
azanium tetradecyl phosphate
CID 19028533
dipotassium;octyl phosphate
CID 29394
calcium;sodium;pentadecyl phosphate
CID 172731404
dipotassium;tetradecyl phosphate
CID 11089999
bis(neodymium(3+));octyl phosphate
CID 141387677

Frequently Asked Questions

What is the IUPAC name of dilithium;tetradecyl phosphate?
The IUPAC name of dilithium;tetradecyl phosphate (CID 139820221) is dilithium;tetradecyl phosphate.
What is the SMILES notation for dilithium;tetradecyl phosphate?
The canonical SMILES for dilithium;tetradecyl phosphate is CCCCCCCCCCCCCCOP(=O)([O-])[O-].[Li+].[Li+].
What is the InChIKey of dilithium;tetradecyl phosphate?
The InChIKey is GZWRFEXIVNSPIB-UHFFFAOYSA-L. The full InChI is InChI=1S/C14H31O4P.2Li/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-19(15,16)17;;/h2-14H2,1H3,(H2,15,16,17);;/q;2*+1/p-2.
What are the key properties of dilithium;tetradecyl phosphate?
dilithium;tetradecyl phosphate has a molecular weight of 306.24 g/mol, XLogP of -2.46, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;tetradecyl phosphate is sourced from PubChem (CID 139820221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).