CID 137270344

C29H30Si5 — CID 137270344

IUPAC—
SMILESC[Si](C#Cc1ccccc1)[Si](C)[Si](C)(C#Cc1ccccc1)[Si](C)[Si](C)C#Cc1ccccc1
InChIInChI=1S/C29H30Si5/c1-30(24-21-27-15-9-6-10-16-27)32(3)34(5,26-23-29-19-13-8-14-20-29)33(4)31(2)25-22-28-17-11-7-12-18-28/h6-20H,1-5H3
InChIKeyHNEBTIFESSOCQD-UHFFFAOYSA-N
MW518.99 g/mol
LogP5.65
Rot. Bonds4

About CID 137270344

CID 137270344 (PubChem CID 137270344) has the molecular formula C29H30Si5 and a molecular weight of 518.99 g/mol.

Molecular Properties

Compound NameCID 137270344
PubChem CID137270344
Molecular FormulaC29H30Si5
Molecular Weight518.99 g/mol
Exact Mass518.12
IUPAC Name—
SMILESC[Si](C#Cc1ccccc1)[Si](C)[Si](C)(C#Cc1ccccc1)[Si](C)[Si](C)C#Cc1ccccc1
InChIInChI=1S/C29H30Si5/c1-30(24-21-27-15-9-6-10-16-27)32(3)34(5,26-23-29-19-13-8-14-20-29)33(4)31(2)25-22-28-17-11-7-12-18-28/h6-20H,1-5H3
InChIKeyHNEBTIFESSOCQD-UHFFFAOYSA-N
XLogP5.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500518.99
LogP ≤ 55.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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2-phenylethynyl-tri(propan-2-yloxy)silane
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CID 122374553

Frequently Asked Questions

What is the IUPAC name of CID 137270344?
The IUPAC name of CID 137270344 (CID 137270344) is not available.
What is the SMILES notation for CID 137270344?
The canonical SMILES for CID 137270344 is C[Si](C#Cc1ccccc1)[Si](C)[Si](C)(C#Cc1ccccc1)[Si](C)[Si](C)C#Cc1ccccc1.
What is the InChIKey of CID 137270344?
The InChIKey is HNEBTIFESSOCQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H30Si5/c1-30(24-21-27-15-9-6-10-16-27)32(3)34(5,26-23-29-19-13-8-14-20-29)33(4)31(2)25-22-28-17-11-7-12-18-28/h6-20H,1-5H3.
What are the key properties of CID 137270344?
CID 137270344 has a molecular weight of 518.99 g/mol, XLogP of 5.65, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 137270344 is sourced from PubChem (CID 137270344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).