lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone

C16H18LiOP — CID 173243819

IUPAClithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone
SMILESCc1cc(C)c(C(=O)c2ccccc2P)c(C)c1.[H-].[Li+]
InChIInChI=1S/C16H17OP.Li.H/c1-10-8-11(2)15(12(3)9-10)16(17)13-6-4-5-7-14(13)18;;/h4-9H,18H2,1-3H3;;/q;+1;-1
InChIKeyFHRPODYQXMYCBA-UHFFFAOYSA-N
MW264.23 g/mol
LogP0.46
Rot. Bonds2

About lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone

lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone (PubChem CID 173243819) has the molecular formula C16H18LiOP and a molecular weight of 264.23 g/mol. Its IUPAC name is lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone.

Molecular Properties

Compound Namelithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone
PubChem CID173243819
Molecular FormulaC16H18LiOP
Molecular Weight264.23 g/mol
Exact Mass264.13
IUPAC Namelithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone
SMILESCc1cc(C)c(C(=O)c2ccccc2P)c(C)c1.[H-].[Li+]
InChIInChI=1S/C16H17OP.Li.H/c1-10-8-11(2)15(12(3)9-10)16(17)13-6-4-5-7-14(13)18;;/h4-9H,18H2,1-3H3;;/q;+1;-1
InChIKeyFHRPODYQXMYCBA-UHFFFAOYSA-N
XLogP0.46
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.23
LogP ≤ 50.46
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

lithium;hydride;(2-phosphanylphenyl)-[2,4,6-tri(propan-2-yl)phenyl]methanone
CID 173244480
sodium;phosphane;2-(2,4,6-trimethylbenzoyl)phenolate
CID 146418297
oxophosphane;(2-phenylphenyl)-(2,4,6-trimethylphenyl)methanone
CID 174367673
[2-phosphoroso-3-(2,4,6-trimethylbenzoyl)phenyl]-(2,4,6-trimethylphenyl)methanone
CID 172735368
ethane;phenyl-(2,4,6-trimethylphenyl)methanone
CID 90795600
benzenesulfonyl 2-(2,4,6-trimethylbenzoyl)benzenesulfonate
CID 54016782
(2,6-dimethylphenyl)-(5-phenoxy-2-phosphanylphenyl)methanone
CID 174396027
(4-bromo-2-fluorophenyl)-(2,4,6-trimethylphenyl)methanone
CID 43337541
(2-bromo-5-methylphenyl)-(2,4,6-trimethylphenyl)methanone
CID 81110554
[4-(2-chlorobenzoyl)-3,5-dimethylphenyl]-(2-chlorophenyl)methanone
CID 25138990
(4-fluoro-2,6-dimethylphenyl)-(2-fluorophenyl)methanone
CID 106876756
[2-(1-hydroxycyclohexyl)phenyl]-[2-(2,4,6-trimethylbenzoyl)phenyl]methanone
CID 121433859

Frequently Asked Questions

What is the IUPAC name of lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone?
The IUPAC name of lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone (CID 173243819) is lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone.
What is the SMILES notation for lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone?
The canonical SMILES for lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone is Cc1cc(C)c(C(=O)c2ccccc2P)c(C)c1.[H-].[Li+].
What is the InChIKey of lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone?
The InChIKey is FHRPODYQXMYCBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17OP.Li.H/c1-10-8-11(2)15(12(3)9-10)16(17)13-6-4-5-7-14(13)18;;/h4-9H,18H2,1-3H3;;/q;+1;-1.
What are the key properties of lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone?
lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone has a molecular weight of 264.23 g/mol, XLogP of 0.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;hydride;(2-phosphanylphenyl)-(2,4,6-trimethylphenyl)methanone is sourced from PubChem (CID 173243819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).