lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone

C19H24LiO4P — CID 173245955

IUPAClithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone
SMILESCOc1cc(OC)c(C(=O)Pc2c(C)cc(C)cc2C)c(OC)c1.[H-].[Li+]
InChIInChI=1S/C19H23O4P.Li.H/c1-11-7-12(2)18(13(3)8-11)24-19(20)17-15(22-5)9-14(21-4)10-16(17)23-6;;/h7-10,24H,1-6H3;;/q;+1;-1
InChIKeyDGHHQDORPQBSSH-UHFFFAOYSA-N
MW354.31 g/mol
LogP0.90
Rot. Bonds6

About lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone

lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone (PubChem CID 173245955) has the molecular formula C19H24LiO4P and a molecular weight of 354.31 g/mol. Its IUPAC name is lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone.

Molecular Properties

Compound Namelithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone
PubChem CID173245955
Molecular FormulaC19H24LiO4P
Molecular Weight354.31 g/mol
Exact Mass354.16
IUPAC Namelithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone
SMILESCOc1cc(OC)c(C(=O)Pc2c(C)cc(C)cc2C)c(OC)c1.[H-].[Li+]
InChIInChI=1S/C19H23O4P.Li.H/c1-11-7-12(2)18(13(3)8-11)24-19(20)17-15(22-5)9-14(21-4)10-16(17)23-6;;/h7-10,24H,1-6H3;;/q;+1;-1
InChIKeyDGHHQDORPQBSSH-UHFFFAOYSA-N
XLogP0.90
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.31
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

lithium (2,6-dimethoxyphenyl)-(2,4,6-trimethoxyphenyl)phosphanylmethanone
CID 18514898
lithium;hydride;(2,4,6-trimethoxyphenyl)-[2,4,6-tris[(2-methylpropan-2-yl)oxy]phenyl]phosphanylmethanone
CID 173245466
lithium (4-methoxyphenyl)phosphanyl-(2,4,6-trimethoxyphenyl)methanone
CID 18514847
lithium (2,6-dimethoxyphenyl)-(2,6-dimethylphenyl)phosphanylmethanone
CID 18514916
lithium;hydride;(2,3,4,6-tetramethylphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone
CID 173243893
lithium;(2,6-dimethoxy-4-methylphenyl)-phenylphosphanylmethanone;hydride
CID 173244321
(2,4,6-trimethoxyphenyl)-[2,4,6-tris(1-methoxyethoxy)phenyl]phosphanylmethanone
CID 18514236
phenylphosphanyl-(2,4,6-trimethoxyphenyl)methanone
CID 70015637
(2,4,6-tributoxyphenyl)phosphanyl-(2,4,6-trimethoxyphenyl)methanone
CID 18514095
CID 70014966
CID 70014966
bis(2,4-dimethoxy-6-methylphenyl)methanone
CID 54389353
lithium;hydride;[2-methyl-4-(3-methylbutoxy)phenyl]phosphanyl-(2,4,6-trimethoxyphenyl)methanone
CID 173244960

Frequently Asked Questions

What is the IUPAC name of lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone?
The IUPAC name of lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone (CID 173245955) is lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone.
What is the SMILES notation for lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone?
The canonical SMILES for lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone is COc1cc(OC)c(C(=O)Pc2c(C)cc(C)cc2C)c(OC)c1.[H-].[Li+].
What is the InChIKey of lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone?
The InChIKey is DGHHQDORPQBSSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23O4P.Li.H/c1-11-7-12(2)18(13(3)8-11)24-19(20)17-15(22-5)9-14(21-4)10-16(17)23-6;;/h7-10,24H,1-6H3;;/q;+1;-1.
What are the key properties of lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone?
lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone has a molecular weight of 354.31 g/mol, XLogP of 0.90, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;hydride;(2,4,6-trimethoxyphenyl)-(2,4,6-trimethylphenyl)phosphanylmethanone is sourced from PubChem (CID 173245955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).