didodecoxymethylsilane

C25H54O2Si — CID 172799979

IUPACdidodecoxymethylsilane
SMILESCCCCCCCCCCCCOC([SiH3])OCCCCCCCCCCCC
InChIInChI=1S/C25H54O2Si/c1-3-5-7-9-11-13-15-17-19-21-23-26-25(28)27-24-22-20-18-16-14-12-10-8-6-4-2/h25H,3-24H2,1-2,28H3
InChIKeyQSRFVDRICMMVIK-UHFFFAOYSA-N
MW414.79 g/mol
LogP7.51
Rot. Bonds24

About didodecoxymethylsilane

didodecoxymethylsilane (PubChem CID 172799979) has the molecular formula C25H54O2Si and a molecular weight of 414.79 g/mol. Its IUPAC name is didodecoxymethylsilane.

Molecular Properties

Compound Namedidodecoxymethylsilane
PubChem CID172799979
Molecular FormulaC25H54O2Si
Molecular Weight414.79 g/mol
Exact Mass414.39
IUPAC Namedidodecoxymethylsilane
SMILESCCCCCCCCCCCCOC([SiH3])OCCCCCCCCCCCC
InChIInChI=1S/C25H54O2Si/c1-3-5-7-9-11-13-15-17-19-21-23-26-25(28)27-24-22-20-18-16-14-12-10-8-6-4-2/h25H,3-24H2,1-2,28H3
InChIKeyQSRFVDRICMMVIK-UHFFFAOYSA-N
XLogP7.51
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds24
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.79
LogP ≤ 57.51
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'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-hexoxypropylsilane
CID 174351834
1-(difluoromethoxy)decane
CID 14400535
icosoxymethanediol
CID 175975847
1-pentan-3-yloxydecane
CID 173279604
octoxymethanediamine
CID 142625053
1-(1-fluorobutoxy)heptane
CID 87417089
1-heptacontoxyethanol
CID 169098461
6-octoxyundecane
CID 20520524
10-decoxyicosane
CID 150196888
dipentoxymethoxysilane
CID 175221676
1-(1-fluoroethoxy)tridecane
CID 175410550
N-(4-propan-2-yloxybutyl)decan-1-amine
CID 106007607

Frequently Asked Questions

What is the IUPAC name of didodecoxymethylsilane?
The IUPAC name of didodecoxymethylsilane (CID 172799979) is didodecoxymethylsilane.
What is the SMILES notation for didodecoxymethylsilane?
The canonical SMILES for didodecoxymethylsilane is CCCCCCCCCCCCOC([SiH3])OCCCCCCCCCCCC.
What is the InChIKey of didodecoxymethylsilane?
The InChIKey is QSRFVDRICMMVIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H54O2Si/c1-3-5-7-9-11-13-15-17-19-21-23-26-25(28)27-24-22-20-18-16-14-12-10-8-6-4-2/h25H,3-24H2,1-2,28H3.
What are the key properties of didodecoxymethylsilane?
didodecoxymethylsilane has a molecular weight of 414.79 g/mol, XLogP of 7.51, 24 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for didodecoxymethylsilane is sourced from PubChem (CID 172799979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).