[2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane

C27H61PSi6 — CID 71415784

IUPAC[2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane
SMILESC[Si](C)(C)C(c1cc(C([Si](C)(C)C)[Si](C)(C)C)c(P)c(C([Si](C)(C)C)[Si](C)(C)C)c1)[Si](C)(C)C
InChIInChI=1S/C27H61PSi6/c1-29(2,3)25(30(4,5)6)21-19-22(26(31(7,8)9)32(10,11)12)24(28)23(20-21)27(33(13,14)15)34(16,17)18/h19-20,25-27H,28H2,1-18H3
InChIKeyAOFFXFPAAPTDQD-UHFFFAOYSA-N
MW585.28 g/mol
LogP9.70
Rot. Bonds9

About [2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane

[2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane (PubChem CID 71415784) has the molecular formula C27H61PSi6 and a molecular weight of 585.28 g/mol. Its IUPAC name is [2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane.

Molecular Properties

Compound Name[2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane
PubChem CID71415784
Molecular FormulaC27H61PSi6
Molecular Weight585.28 g/mol
Exact Mass584.31
IUPAC Name[2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane
SMILESC[Si](C)(C)C(c1cc(C([Si](C)(C)C)[Si](C)(C)C)c(P)c(C([Si](C)(C)C)[Si](C)(C)C)c1)[Si](C)(C)C
InChIInChI=1S/C27H61PSi6/c1-29(2,3)25(30(4,5)6)21-19-22(26(31(7,8)9)32(10,11)12)24(28)23(20-21)27(33(13,14)15)34(16,17)18/h19-20,25-27H,28H2,1-18H3
InChIKeyAOFFXFPAAPTDQD-UHFFFAOYSA-N
XLogP9.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500585.28
LogP ≤ 59.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Trimethylbenzylsilane
CID 69862
p-Tolyltrimethylsilane
CID 298149
alpha,alpha,alpha-Tris(trimethylsilyl)ethylbenzene
CID 142009
(P-Tolyl)triethylsilane
CID 4588896
Vinyldimethylbenzylsilane
CID 140320
Silane, trimethyl-O-tolyl-
CID 522544
Silane, trimethyl(1-phenylethenyl)-
CID 137259
Silane, (phenylmethylene)bis(trimethyl-
CID 139789
Silane, (1,3-phenylenebis(methylene))bis(trimethyl-
CID 140383
1,3-Bis[(trimethylsilyl)ethynyl]benzene
CID 142239
Silane, (1,3,5-benzenetriyltris(methylene)tris(trimethyl-
CID 143608
Styryltrimethylsilane
CID 5314555

Frequently Asked Questions

What is the IUPAC name of [2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane?
The IUPAC name of [2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane (CID 71415784) is [2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane.
What is the SMILES notation for [2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane?
The canonical SMILES for [2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane is C[Si](C)(C)C(c1cc(C([Si](C)(C)C)[Si](C)(C)C)c(P)c(C([Si](C)(C)C)[Si](C)(C)C)c1)[Si](C)(C)C.
What is the InChIKey of [2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane?
The InChIKey is AOFFXFPAAPTDQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H61PSi6/c1-29(2,3)25(30(4,5)6)21-19-22(26(31(7,8)9)32(10,11)12)24(28)23(20-21)27(33(13,14)15)34(16,17)18/h19-20,25-27H,28H2,1-18H3.
What are the key properties of [2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane?
[2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane has a molecular weight of 585.28 g/mol, XLogP of 9.70, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2,4,6-tris[bis(trimethylsilyl)methyl]phenyl]phosphane is sourced from PubChem (CID 71415784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).