lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride

C16H18LiOP — CID 174386730

IUPAClithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride
SMILESCCPC(=O)c1c(C)cccc1-c1ccccc1.[H-].[Li+]
InChIInChI=1S/C16H17OP.Li.H/c1-3-18-16(17)15-12(2)8-7-11-14(15)13-9-5-4-6-10-13;;/h4-11,18H,3H2,1-2H3;;/q;+1;-1
InChIKeyOZEATCSFVOWKSO-UHFFFAOYSA-N
MW264.23 g/mol
LogP1.62
Rot. Bonds4

About lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride

lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride (PubChem CID 174386730) has the molecular formula C16H18LiOP and a molecular weight of 264.23 g/mol. Its IUPAC name is lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride.

Molecular Properties

Compound Namelithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride
PubChem CID174386730
Molecular FormulaC16H18LiOP
Molecular Weight264.23 g/mol
Exact Mass264.13
IUPAC Namelithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride
SMILESCCPC(=O)c1c(C)cccc1-c1ccccc1.[H-].[Li+]
InChIInChI=1S/C16H17OP.Li.H/c1-3-18-16(17)15-12(2)8-7-11-14(15)13-9-5-4-6-10-13;;/h4-11,18H,3H2,1-2H3;;/q;+1;-1
InChIKeyOZEATCSFVOWKSO-UHFFFAOYSA-N
XLogP1.62
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.23
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

CID 160597109
CID 160597109
lithium;(2-chloro-6-methylphenyl)-ethylphosphanylmethanone;hydride
CID 174400898
ethyl 2-methyl-6-phenylbenzoate
CID 86249615
lithium;hydride;1-(2-methyl-6-phenylphenyl)-2-phosphanylpropan-1-one
CID 174476920
CID 159103638
CID 159103638
lithium (2-methyl-6-phenylbenzoyl)-(2-methylpropyl)phosphanide
CID 141023057
carbonic acid;1,2-dimethyl-3-phenylbenzene
CID 67785413
(2,6-dimethylphenyl)-[(2-methyl-6-phenylbenzoyl)-phenylphosphoryl]methanone
CID 70014310
lithium;hydride;1-methyl-2,3-diphenylbenzene
CID 175388205
(2S)-2-[(2-methyl-6-phenylbenzoyl)amino]-4-sulfobutanoic acid
CID 89123732
2-N,2-N-diethyl-1-N,3-dimethyl-1-N-(2-phenylphenyl)benzene-1,2-dicarboxamide
CID 67628353
acetic acid;1-ethyl-2-phenylbenzene
CID 67681814

Frequently Asked Questions

What is the IUPAC name of lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride?
The IUPAC name of lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride (CID 174386730) is lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride.
What is the SMILES notation for lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride?
The canonical SMILES for lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride is CCPC(=O)c1c(C)cccc1-c1ccccc1.[H-].[Li+].
What is the InChIKey of lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride?
The InChIKey is OZEATCSFVOWKSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17OP.Li.H/c1-3-18-16(17)15-12(2)8-7-11-14(15)13-9-5-4-6-10-13;;/h4-11,18H,3H2,1-2H3;;/q;+1;-1.
What are the key properties of lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride?
lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride has a molecular weight of 264.23 g/mol, XLogP of 1.62, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;ethylphosphanyl-(2-methyl-6-phenylphenyl)methanone;hydride is sourced from PubChem (CID 174386730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).