CID 20640903

C14H29O2Si3 — CID 20640903

IUPAC—
SMILESC[Si](C)(CC[Si])O[Si](C)(C)CCC1CCC2OC2C1
InChIInChI=1S/C14H29O2Si3/c1-18(2,16-19(3,4)10-8-17)9-7-12-5-6-13-14(11-12)15-13/h12-14H,5-11H2,1-4H3
InChIKeyHTFGVKUBYZEMNA-UHFFFAOYSA-N
MW313.64 g/mol
LogP3.96
Rot. Bonds7

About CID 20640903

CID 20640903 (PubChem CID 20640903) has the molecular formula C14H29O2Si3 and a molecular weight of 313.64 g/mol.

Molecular Properties

Compound NameCID 20640903
PubChem CID20640903
Molecular FormulaC14H29O2Si3
Molecular Weight313.64 g/mol
Exact Mass313.15
IUPAC Name—
SMILESC[Si](C)(CC[Si])O[Si](C)(C)CCC1CCC2OC2C1
InChIInChI=1S/C14H29O2Si3/c1-18(2,16-19(3,4)10-8-17)9-7-12-5-6-13-14(11-12)15-13/h12-14H,5-11H2,1-4H3
InChIKeyHTFGVKUBYZEMNA-UHFFFAOYSA-N
XLogP3.96
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.64
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 20640903?
The IUPAC name of CID 20640903 (CID 20640903) is not available.
What is the SMILES notation for CID 20640903?
The canonical SMILES for CID 20640903 is C[Si](C)(CC[Si])O[Si](C)(C)CCC1CCC2OC2C1.
What is the InChIKey of CID 20640903?
The InChIKey is HTFGVKUBYZEMNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29O2Si3/c1-18(2,16-19(3,4)10-8-17)9-7-12-5-6-13-14(11-12)15-13/h12-14H,5-11H2,1-4H3.
What are the key properties of CID 20640903?
CID 20640903 has a molecular weight of 313.64 g/mol, XLogP of 3.96, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 20640903 is sourced from PubChem (CID 20640903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).