chloromethyl-phenyl-di(propan-2-yloxy)silane

C13H21ClO2Si — CID 13392408

IUPACchloromethyl-phenyl-di(propan-2-yloxy)silane
SMILESCC(C)O[Si](CCl)(OC(C)C)c1ccccc1
InChIInChI=1S/C13H21ClO2Si/c1-11(2)15-17(10-14,16-12(3)4)13-8-6-5-7-9-13/h5-9,11-12H,10H2,1-4H3
InChIKeyIKDFAPHTXUQMBG-UHFFFAOYSA-N
MW272.85 g/mol
LogP2.96
Rot. Bonds6

About chloromethyl-phenyl-di(propan-2-yloxy)silane

chloromethyl-phenyl-di(propan-2-yloxy)silane (PubChem CID 13392408) has the molecular formula C13H21ClO2Si and a molecular weight of 272.85 g/mol. Its IUPAC name is chloromethyl-phenyl-di(propan-2-yloxy)silane.

Molecular Properties

Compound Namechloromethyl-phenyl-di(propan-2-yloxy)silane
PubChem CID13392408
Molecular FormulaC13H21ClO2Si
Molecular Weight272.85 g/mol
Exact Mass272.10
IUPAC Namechloromethyl-phenyl-di(propan-2-yloxy)silane
SMILESCC(C)O[Si](CCl)(OC(C)C)c1ccccc1
InChIInChI=1S/C13H21ClO2Si/c1-11(2)15-17(10-14,16-12(3)4)13-8-6-5-7-9-13/h5-9,11-12H,10H2,1-4H3
InChIKeyIKDFAPHTXUQMBG-UHFFFAOYSA-N
XLogP2.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.85
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze chloromethyl-phenyl-di(propan-2-yloxy)silane 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

methyl-phenyl-di(propan-2-yloxy)silane
CID 15206336
methyl-(methyl-phenyl-propan-2-yloxysilyl)-phenyl-propan-2-yloxysilane
CID 102481335
isocyanatomethyl-phenyl-di(propan-2-yloxy)silane
CID 142701813
oxetan-3-ylmethyl-phenyl-di(propan-2-yloxy)silane
CID 141200033
phenyl-tri(propan-2-yloxy)silane;triethoxy(phenyl)silane
CID 159737253
magnesium;ethyl-diphenyl-propan-2-yloxysilane;chloride
CID 59538138
chloromethyl-methoxy-diphenylsilane
CID 66969961
[diphenyl(propan-2-yloxy)silyl]oxy-diphenyl-trimethylsilyloxysilane
CID 176887481
propan-2-yl 2-[methyl(diphenyl)silyl]acetate
CID 13197434
[diethyl(trimethylsilyloxy)silyl]oxy-diphenyl-propan-2-yloxysilane
CID 149048031
(amino-phenyl-propan-2-ylsilyl)benzene
CID 54544668
dimethyl-(2-phenylethyl)-propan-2-yloxysilane
CID 58897732

Frequently Asked Questions

What is the IUPAC name of chloromethyl-phenyl-di(propan-2-yloxy)silane?
The IUPAC name of chloromethyl-phenyl-di(propan-2-yloxy)silane (CID 13392408) is chloromethyl-phenyl-di(propan-2-yloxy)silane.
What is the SMILES notation for chloromethyl-phenyl-di(propan-2-yloxy)silane?
The canonical SMILES for chloromethyl-phenyl-di(propan-2-yloxy)silane is CC(C)O[Si](CCl)(OC(C)C)c1ccccc1.
What is the InChIKey of chloromethyl-phenyl-di(propan-2-yloxy)silane?
The InChIKey is IKDFAPHTXUQMBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21ClO2Si/c1-11(2)15-17(10-14,16-12(3)4)13-8-6-5-7-9-13/h5-9,11-12H,10H2,1-4H3.
What are the key properties of chloromethyl-phenyl-di(propan-2-yloxy)silane?
chloromethyl-phenyl-di(propan-2-yloxy)silane has a molecular weight of 272.85 g/mol, XLogP of 2.96, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethyl-phenyl-di(propan-2-yloxy)silane is sourced from PubChem (CID 13392408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).