CID 176657904

C23H49O2Si — CID 176657904

IUPAC—
SMILESCCCCCCCCCCCCCCCCC[Si](OC(C)C)OC(C)C
InChIInChI=1S/C23H49O2Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26(24-22(2)3)25-23(4)5/h22-23H,6-21H2,1-5H3
InChIKeyHIXQOSZHRPIEHD-UHFFFAOYSA-N
MW385.73 g/mol
LogP8.20
Rot. Bonds20

About CID 176657904

CID 176657904 (PubChem CID 176657904) has the molecular formula C23H49O2Si and a molecular weight of 385.73 g/mol.

Molecular Properties

Compound NameCID 176657904
PubChem CID176657904
Molecular FormulaC23H49O2Si
Molecular Weight385.73 g/mol
Exact Mass385.35
IUPAC Name—
SMILESCCCCCCCCCCCCCCCCC[Si](OC(C)C)OC(C)C
InChIInChI=1S/C23H49O2Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26(24-22(2)3)25-23(4)5/h22-23H,6-21H2,1-5H3
InChIKeyHIXQOSZHRPIEHD-UHFFFAOYSA-N
XLogP8.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds20
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.73
LogP ≤ 58.20
H-Bond Donors ≤ 50
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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Related Compounds

decane;ruthenium
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ethane;heptane;2-methylpropane
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iodomethane;octadecane
CID 174964097
CID 21462171
CID 21462171
trihexadecyl(methyl)phosphanium
CID 22750516
triheptyl(methyl)phosphanium
CID 87447401
1-(4-propan-2-yloxybutoxy)tetradecane
CID 167327232
CID 123213409
CID 123213409
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
decane;heptane
CID 159049036

Frequently Asked Questions

What is the IUPAC name of CID 176657904?
The IUPAC name of CID 176657904 (CID 176657904) is not available.
What is the SMILES notation for CID 176657904?
The canonical SMILES for CID 176657904 is CCCCCCCCCCCCCCCCC[Si](OC(C)C)OC(C)C.
What is the InChIKey of CID 176657904?
The InChIKey is HIXQOSZHRPIEHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H49O2Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26(24-22(2)3)25-23(4)5/h22-23H,6-21H2,1-5H3.
What are the key properties of CID 176657904?
CID 176657904 has a molecular weight of 385.73 g/mol, XLogP of 8.20, 20 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 176657904 is sourced from PubChem (CID 176657904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).