CID 67718097

C24H41O2Si — CID 67718097

IUPAC—
SMILESCCCCCCCCC(O)C=Cc1cccc(C(O[Si](C)C)C(C)(C)C)c1
InChIInChI=1S/C24H41O2Si/c1-7-8-9-10-11-12-16-22(25)18-17-20-14-13-15-21(19-20)23(24(2,3)4)26-27(5)6/h13-15,17-19,22-23,25H,7-12,16H2,1-6H3
InChIKeyZWOOEFBQKYNLDW-UHFFFAOYSA-N
MW389.68 g/mol
LogP7.17
Rot. Bonds12

About CID 67718097

CID 67718097 (PubChem CID 67718097) has the molecular formula C24H41O2Si and a molecular weight of 389.68 g/mol.

Molecular Properties

Compound NameCID 67718097
PubChem CID67718097
Molecular FormulaC24H41O2Si
Molecular Weight389.68 g/mol
Exact Mass389.29
IUPAC Name—
SMILESCCCCCCCCC(O)C=Cc1cccc(C(O[Si](C)C)C(C)(C)C)c1
InChIInChI=1S/C24H41O2Si/c1-7-8-9-10-11-12-16-22(25)18-17-20-14-13-15-21(19-20)23(24(2,3)4)26-27(5)6/h13-15,17-19,22-23,25H,7-12,16H2,1-6H3
InChIKeyZWOOEFBQKYNLDW-UHFFFAOYSA-N
XLogP7.17
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.68
LogP ≤ 57.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 67718097?
The IUPAC name of CID 67718097 (CID 67718097) is not available.
What is the SMILES notation for CID 67718097?
The canonical SMILES for CID 67718097 is CCCCCCCCC(O)C=Cc1cccc(C(O[Si](C)C)C(C)(C)C)c1.
What is the InChIKey of CID 67718097?
The InChIKey is ZWOOEFBQKYNLDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H41O2Si/c1-7-8-9-10-11-12-16-22(25)18-17-20-14-13-15-21(19-20)23(24(2,3)4)26-27(5)6/h13-15,17-19,22-23,25H,7-12,16H2,1-6H3.
What are the key properties of CID 67718097?
CID 67718097 has a molecular weight of 389.68 g/mol, XLogP of 7.17, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 67718097 is sourced from PubChem (CID 67718097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).