CID 136741776

C20H37Si5 — CID 136741776

IUPAC—
SMILESC#CC1=C([Si](C)(C)C)[Si](C)(C)C([Si](C)(C)C)=C1C#C[Si](C)(C)[Si](C)C
InChIInChI=1S/C20H37Si5/c1-14-17-18(15-16-24(10,11)21(2)3)20(23(7,8)9)25(12,13)19(17)22(4,5)6/h1H,2-13H3
InChIKeyHRPMKEHWUYKTPH-UHFFFAOYSA-N
MW417.95 g/mol
LogP5.85
Rot. Bonds3

About CID 136741776

CID 136741776 (PubChem CID 136741776) has the molecular formula C20H37Si5 and a molecular weight of 417.95 g/mol.

Molecular Properties

Compound NameCID 136741776
PubChem CID136741776
Molecular FormulaC20H37Si5
Molecular Weight417.95 g/mol
Exact Mass417.17
IUPAC Name—
SMILESC#CC1=C([Si](C)(C)C)[Si](C)(C)C([Si](C)(C)C)=C1C#C[Si](C)(C)[Si](C)C
InChIInChI=1S/C20H37Si5/c1-14-17-18(15-16-24(10,11)21(2)3)20(23(7,8)9)25(12,13)19(17)22(4,5)6/h1H,2-13H3
InChIKeyHRPMKEHWUYKTPH-UHFFFAOYSA-N
XLogP5.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500417.95
LogP ≤ 55.85
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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Frequently Asked Questions

What is the IUPAC name of CID 136741776?
The IUPAC name of CID 136741776 (CID 136741776) is not available.
What is the SMILES notation for CID 136741776?
The canonical SMILES for CID 136741776 is C#CC1=C([Si](C)(C)C)[Si](C)(C)C([Si](C)(C)C)=C1C#C[Si](C)(C)[Si](C)C.
What is the InChIKey of CID 136741776?
The InChIKey is HRPMKEHWUYKTPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H37Si5/c1-14-17-18(15-16-24(10,11)21(2)3)20(23(7,8)9)25(12,13)19(17)22(4,5)6/h1H,2-13H3.
What are the key properties of CID 136741776?
CID 136741776 has a molecular weight of 417.95 g/mol, XLogP of 5.85, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136741776 is sourced from PubChem (CID 136741776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).