CID 68757374

C17H33O2Si — CID 68757374

IUPAC—
SMILESCCCCC(CC)C[Si](OC)OC=CC1CCCCC1
InChIInChI=1S/C17H33O2Si/c1-4-6-10-16(5-2)15-20(18-3)19-14-13-17-11-8-7-9-12-17/h13-14,16-17H,4-12,15H2,1-3H3
InChIKeyNDYYQAYUTLIKIH-UHFFFAOYSA-N
MW297.53 g/mol
LogP5.45
Rot. Bonds10

About CID 68757374

CID 68757374 (PubChem CID 68757374) has the molecular formula C17H33O2Si and a molecular weight of 297.53 g/mol.

Molecular Properties

Compound NameCID 68757374
PubChem CID68757374
Molecular FormulaC17H33O2Si
Molecular Weight297.53 g/mol
Exact Mass297.22
IUPAC Name—
SMILESCCCCC(CC)C[Si](OC)OC=CC1CCCCC1
InChIInChI=1S/C17H33O2Si/c1-4-6-10-16(5-2)15-20(18-3)19-14-13-17-11-8-7-9-12-17/h13-14,16-17H,4-12,15H2,1-3H3
InChIKeyNDYYQAYUTLIKIH-UHFFFAOYSA-N
XLogP5.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.53
LogP ≤ 55.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 68757374?
The IUPAC name of CID 68757374 (CID 68757374) is not available.
What is the SMILES notation for CID 68757374?
The canonical SMILES for CID 68757374 is CCCCC(CC)C[Si](OC)OC=CC1CCCCC1.
What is the InChIKey of CID 68757374?
The InChIKey is NDYYQAYUTLIKIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33O2Si/c1-4-6-10-16(5-2)15-20(18-3)19-14-13-17-11-8-7-9-12-17/h13-14,16-17H,4-12,15H2,1-3H3.
What are the key properties of CID 68757374?
CID 68757374 has a molecular weight of 297.53 g/mol, XLogP of 5.45, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 68757374 is sourced from PubChem (CID 68757374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).