chloromethyl-dimethyl-tridecan-2-yloxysilane

C16H35ClOSi — CID 554737

IUPACchloromethyl-dimethyl-tridecan-2-yloxysilane
SMILESCCCCCCCCCCCC(C)O[Si](C)(C)CCl
InChIInChI=1S/C16H35ClOSi/c1-5-6-7-8-9-10-11-12-13-14-16(2)18-19(3,4)15-17/h16H,5-15H2,1-4H3
InChIKeyRLMGVPNYZWEPKM-UHFFFAOYSA-N
MW306.99 g/mol
LogP6.30
Rot. Bonds13

About chloromethyl-dimethyl-tridecan-2-yloxysilane

chloromethyl-dimethyl-tridecan-2-yloxysilane (PubChem CID 554737) has the molecular formula C16H35ClOSi and a molecular weight of 306.99 g/mol. Its IUPAC name is chloromethyl-dimethyl-tridecan-2-yloxysilane.

Molecular Properties

Compound Namechloromethyl-dimethyl-tridecan-2-yloxysilane
PubChem CID554737
Molecular FormulaC16H35ClOSi
Molecular Weight306.99 g/mol
Exact Mass306.21
IUPAC Namechloromethyl-dimethyl-tridecan-2-yloxysilane
SMILESCCCCCCCCCCCC(C)O[Si](C)(C)CCl
InChIInChI=1S/C16H35ClOSi/c1-5-6-7-8-9-10-11-12-13-14-16(2)18-19(3,4)15-17/h16H,5-15H2,1-4H3
InChIKeyRLMGVPNYZWEPKM-UHFFFAOYSA-N
XLogP6.30
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.99
LogP ≤ 56.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze chloromethyl-dimethyl-tridecan-2-yloxysilane 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

chloromethyl-dimethyl-tridecan-5-yloxysilane
CID 554244
butyl-dimethyl-tetradecan-2-yloxysilane
CID 554593
dimethyl-pentadecan-2-yloxy-prop-2-enylsilane
CID 554910
triethyl(tetradecan-2-yloxy)silane
CID 568550
tert-butyl-dimethyl-pentadecan-2-yloxysilane
CID 6430239
diethoxy-hexadecan-2-yloxy-methylsilane
CID 176915381
tert-butyl-dimethyl-tridecan-2-yloxysilane
CID 102272520
ethenyl-dimethyl-tridecan-2-yloxysilane
CID 582172
ethenyl-dimethyl-pentadecan-2-yloxysilane
CID 582173
chloromethyl-dimethyl-octan-4-yloxysilane
CID 554607
dimethyl-(2-methylpropoxy)-octan-2-yloxysilane
CID 91726674
dodecan-6-yloxy-ethyl-dimethylsilane
CID 536242

Frequently Asked Questions

What is the IUPAC name of chloromethyl-dimethyl-tridecan-2-yloxysilane?
The IUPAC name of chloromethyl-dimethyl-tridecan-2-yloxysilane (CID 554737) is chloromethyl-dimethyl-tridecan-2-yloxysilane.
What is the SMILES notation for chloromethyl-dimethyl-tridecan-2-yloxysilane?
The canonical SMILES for chloromethyl-dimethyl-tridecan-2-yloxysilane is CCCCCCCCCCCC(C)O[Si](C)(C)CCl.
What is the InChIKey of chloromethyl-dimethyl-tridecan-2-yloxysilane?
The InChIKey is RLMGVPNYZWEPKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35ClOSi/c1-5-6-7-8-9-10-11-12-13-14-16(2)18-19(3,4)15-17/h16H,5-15H2,1-4H3.
What are the key properties of chloromethyl-dimethyl-tridecan-2-yloxysilane?
chloromethyl-dimethyl-tridecan-2-yloxysilane has a molecular weight of 306.99 g/mol, XLogP of 6.30, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethyl-dimethyl-tridecan-2-yloxysilane is sourced from PubChem (CID 554737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).