CID 174866702

C18H41OSi — CID 174866702

IUPAC—
SMILESCCCCCCCCCCCCCCCC[Si](C)C.O
InChIInChI=1S/C18H39Si.H2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(2)3;/h4-18H2,1-3H3;1H2
InChIKeyILUYECVUOVGYRD-UHFFFAOYSA-N
MW301.61 g/mol
LogP6.40
Rot. Bonds15

About CID 174866702

CID 174866702 (PubChem CID 174866702) has the molecular formula C18H41OSi and a molecular weight of 301.61 g/mol.

Molecular Properties

Compound NameCID 174866702
PubChem CID174866702
Molecular FormulaC18H41OSi
Molecular Weight301.61 g/mol
Exact Mass301.29
IUPAC Name—
SMILESCCCCCCCCCCCCCCCC[Si](C)C.O
InChIInChI=1S/C18H39Si.H2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(2)3;/h4-18H2,1-3H3;1H2
InChIKeyILUYECVUOVGYRD-UHFFFAOYSA-N
XLogP6.40
TPSA31.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.61
LogP ≤ 56.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 174866702 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 21462171
CID 21462171
Dihexylfluorosilane
CID 15791873
heptane;hydrate
CID 57468513
CID 137150635
CID 137150635
methyloctylsiloxane
CID 21243982
decane;heptane
CID 159049036
(1,2,3,4,5,6,7,8,9,10,11,12-13C12)dodecane
CID 71309250
dodecane;pentadecane
CID 162065772
dohexacontane
CID 522644
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782
hexane;tetrahydrate
CID 174107213

Frequently Asked Questions

What is the IUPAC name of CID 174866702?
The IUPAC name of CID 174866702 (CID 174866702) is not available.
What is the SMILES notation for CID 174866702?
The canonical SMILES for CID 174866702 is CCCCCCCCCCCCCCCC[Si](C)C.O.
What is the InChIKey of CID 174866702?
The InChIKey is ILUYECVUOVGYRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H39Si.H2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(2)3;/h4-18H2,1-3H3;1H2.
What are the key properties of CID 174866702?
CID 174866702 has a molecular weight of 301.61 g/mol, XLogP of 6.40, 15 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174866702 is sourced from PubChem (CID 174866702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).