[5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane

C25H32Cl3O2PSi3 — CID 164886965

IUPAC[5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane
SMILESC[Si](C)(C)O[Si](C)(O[Si](C)(C)C)c1ccc(Cl)cc1P(c1cccc(Cl)c1)c1cccc(Cl)c1
InChIInChI=1S/C25H32Cl3O2PSi3/c1-32(2,3)29-34(7,30-33(4,5)6)25-15-14-21(28)18-24(25)31(22-12-8-10-19(26)16-22)23-13-9-11-20(27)17-23/h8-18H,1-7H3
InChIKeyYXDJWIPJJYRCGQ-UHFFFAOYSA-N
MW586.12 g/mol
LogP7.39
Rot. Bonds8

About [5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane

[5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane (PubChem CID 164886965) has the molecular formula C25H32Cl3O2PSi3 and a molecular weight of 586.12 g/mol. Its IUPAC name is [5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane.

Molecular Properties

Compound Name[5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane
PubChem CID164886965
Molecular FormulaC25H32Cl3O2PSi3
Molecular Weight586.12 g/mol
Exact Mass584.05
IUPAC Name[5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane
SMILESC[Si](C)(C)O[Si](C)(O[Si](C)(C)C)c1ccc(Cl)cc1P(c1cccc(Cl)c1)c1cccc(Cl)c1
InChIInChI=1S/C25H32Cl3O2PSi3/c1-32(2,3)29-34(7,30-33(4,5)6)25-15-14-21(28)18-24(25)31(22-12-8-10-19(26)16-22)23-13-9-11-20(27)17-23/h8-18H,1-7H3
InChIKeyYXDJWIPJJYRCGQ-UHFFFAOYSA-N
XLogP7.39
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500586.12
LogP ≤ 57.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(3-chlorophenyl)-tris(trimethylsilyloxy)silane
CID 139696878
(4-chloro-2-methylphenyl)-diphenylphosphane
CID 100913649
bis(4-chloro-2-methylphenyl)-phenylphosphane
CID 59575015
2-[(3-chlorophenyl)-(2-hydroxyethyl)phosphanyl]ethanol
CID 23082166
azane;1,3-dichlorobenzene
CID 67301049
1,3-dichlorobenzene;trihydrofluoride
CID 172846672
[(E)-2-(3-chlorophenyl)ethenyl]-trimethylsilane
CID 15743326
(3-chlorophenyl)-methyl-diphenylsilane
CID 101069802
magnesium;1,3-dichlorobenzene;hydride
CID 173052292
sodium;1,3-dichlorobenzene;hydride
CID 175271520
(3-chlorophenoxy)-dimethyl-(2,3,4,5,6-pentafluorophenyl)silane
CID 91743588
trimethyl-[methyl-(2-methyl-1,3-benzoxazol-7-yl)-trimethylsilyloxysilyl]oxysilane
CID 140856852

Frequently Asked Questions

What is the IUPAC name of [5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane?
The IUPAC name of [5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane (CID 164886965) is [5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane.
What is the SMILES notation for [5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane?
The canonical SMILES for [5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane is C[Si](C)(C)O[Si](C)(O[Si](C)(C)C)c1ccc(Cl)cc1P(c1cccc(Cl)c1)c1cccc(Cl)c1.
What is the InChIKey of [5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane?
The InChIKey is YXDJWIPJJYRCGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32Cl3O2PSi3/c1-32(2,3)29-34(7,30-33(4,5)6)25-15-14-21(28)18-24(25)31(22-12-8-10-19(26)16-22)23-13-9-11-20(27)17-23/h8-18H,1-7H3.
What are the key properties of [5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane?
[5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane has a molecular weight of 586.12 g/mol, XLogP of 7.39, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-2-[methyl-bis(trimethylsilyloxy)silyl]phenyl]-bis(3-chlorophenyl)phosphane is sourced from PubChem (CID 164886965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).