[[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene

C26H40ClO3PSi2 — CID 159449240

IUPAC[[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene
SMILESC=C.C=C.Cc1cc(C)c(C(=O)P(=O)(C[Si](C)(C)O[Si](C)(C)CCl)c2ccccc2)c(C)c1
InChIInChI=1S/C22H32ClO3PSi2.2C2H4/c1-17-13-18(2)21(19(3)14-17)22(24)27(25,20-11-9-8-10-12-20)16-29(6,7)26-28(4,5)15-23;2*1-2/h8-14H,15-16H2,1-7H3;2*1-2H2
InChIKeyLTDPRKZLWUUNOW-UHFFFAOYSA-N
MW523.20 g/mol
LogP7.79
Rot. Bonds8

About [[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene

[[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene (PubChem CID 159449240) has the molecular formula C26H40ClO3PSi2 and a molecular weight of 523.20 g/mol. Its IUPAC name is [[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene.

Molecular Properties

Compound Name[[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene
PubChem CID159449240
Molecular FormulaC26H40ClO3PSi2
Molecular Weight523.20 g/mol
Exact Mass522.19
IUPAC Name[[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene
SMILESC=C.C=C.Cc1cc(C)c(C(=O)P(=O)(C[Si](C)(C)O[Si](C)(C)CCl)c2ccccc2)c(C)c1
InChIInChI=1S/C22H32ClO3PSi2.2C2H4/c1-17-13-18(2)21(19(3)14-17)22(24)27(25,20-11-9-8-10-12-20)16-29(6,7)26-28(4,5)15-23;2*1-2/h8-14H,15-16H2,1-7H3;2*1-2H2
InChIKeyLTDPRKZLWUUNOW-UHFFFAOYSA-N
XLogP7.79
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500523.20
LogP ≤ 57.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze [[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene with MolForge

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Related Compounds

[2-ethenoxyethyl(phenyl)phosphoryl]-(2,4,6-trimethylphenyl)methanone
CID 58752978
diphenylphosphoryl-(2,4,6-trimethylphenyl)methanone;oxophosphane
CID 118610994
[amino(phenyl)phosphoryl]-(2,4,6-trimethylphenyl)methanone
CID 68512342
3-methylbutyl 3-[phenyl-(2,4,6-trimethylbenzoyl)phosphoryl]propanoate
CID 151707072
sodium phenyl-(2,4,6-trimethylbenzoyl)phosphinate
CID 23690966
2-chloro-1-[2,4,6-trimethyl-3-[phenyl-(2,4,6-trimethylbenzoyl)phosphoryl]carbonylphenyl]ethanone
CID 140903554
[phenyl-(2,4,6-trimethylbenzoyl)phosphoryl]-[2-[phenyl-(2,4,6-trimethylbenzoyl)phosphoryl]carbonylphenyl]methanone
CID 21343895
CID 157152357
CID 157152357
(4-tert-butyl-2,6-dimethylphenyl)-[ethyl(phenyl)phosphoryl]methanone
CID 18513883
[(4-methylphenoxy)-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone
CID 18983511
[ethoxy(phenyl)phosphoryl]-(2,4,6-trimethylphenyl)methanone;[methoxy(phenyl)phosphoryl]-(2,4,6-trimethylphenyl)methanone
CID 161461233
[3-[ethoxy-[ethoxy(dimethyl)silyl]oxy-phenylsilyl]propyl-(2,4,6-trimethylbenzoyl)phosphoryl]-(2,4,6-trimethylphenyl)methanone
CID 67952431

Frequently Asked Questions

What is the IUPAC name of [[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene?
The IUPAC name of [[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene (CID 159449240) is [[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene.
What is the SMILES notation for [[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene?
The canonical SMILES for [[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene is C=C.C=C.Cc1cc(C)c(C(=O)P(=O)(C[Si](C)(C)O[Si](C)(C)CCl)c2ccccc2)c(C)c1.
What is the InChIKey of [[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene?
The InChIKey is LTDPRKZLWUUNOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32ClO3PSi2.2C2H4/c1-17-13-18(2)21(19(3)14-17)22(24)27(25,20-11-9-8-10-12-20)16-29(6,7)26-28(4,5)15-23;2*1-2/h8-14H,15-16H2,1-7H3;2*1-2H2.
What are the key properties of [[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene?
[[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene has a molecular weight of 523.20 g/mol, XLogP of 7.79, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [[[chloromethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl-phenylphosphoryl]-(2,4,6-trimethylphenyl)methanone;ethene is sourced from PubChem (CID 159449240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).