benzyl-(chloromethyl)-methoxysilane

C9H13ClOSi — CID 154313089

IUPACbenzyl-(chloromethyl)-methoxysilane
SMILESCO[SiH](CCl)Cc1ccccc1
InChIInChI=1S/C9H13ClOSi/c1-11-12(8-10)7-9-5-3-2-4-6-9/h2-6,12H,7-8H2,1H3
InChIKeyZPZITBKYDWTZKO-UHFFFAOYSA-N
MW200.74 g/mol
LogP1.92
Rot. Bonds4

About benzyl-(chloromethyl)-methoxysilane

benzyl-(chloromethyl)-methoxysilane (PubChem CID 154313089) has the molecular formula C9H13ClOSi and a molecular weight of 200.74 g/mol. Its IUPAC name is benzyl-(chloromethyl)-methoxysilane.

Molecular Properties

Compound Namebenzyl-(chloromethyl)-methoxysilane
PubChem CID154313089
Molecular FormulaC9H13ClOSi
Molecular Weight200.74 g/mol
Exact Mass200.04
IUPAC Namebenzyl-(chloromethyl)-methoxysilane
SMILESCO[SiH](CCl)Cc1ccccc1
InChIInChI=1S/C9H13ClOSi/c1-11-12(8-10)7-9-5-3-2-4-6-9/h2-6,12H,7-8H2,1H3
InChIKeyZPZITBKYDWTZKO-UHFFFAOYSA-N
XLogP1.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.74
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

dibenzylsilyloxy-tri(propan-2-yl)silane
CID 154004078
chloromethylbenzene;ruthenium
CID 161305198
benzylbenzene;methoxymethane
CID 161110966
benzyl-[1,2-bis[[benzyl(methoxy)silyl]oxy]-2-silylethenoxy]-methoxysilane
CID 149435598
benzylbenzene;ethane;methoxymethane
CID 159187560
benzyl-tert-butyl-propan-2-yloxysilane
CID 154119983
benzyl(dipropoxy)silane
CID 123358150
chloromethylbenzene;methane
CID 174969037
CID 18435300
CID 18435300
(2-methoxy-2-methylpropyl)benzene
CID 3842751
(1-chloro-3-iodo-2-methylpropan-2-yl)oxymethylbenzene
CID 114772524
methoxymethylbenzene;silane
CID 174277199

Frequently Asked Questions

What is the IUPAC name of benzyl-(chloromethyl)-methoxysilane?
The IUPAC name of benzyl-(chloromethyl)-methoxysilane (CID 154313089) is benzyl-(chloromethyl)-methoxysilane.
What is the SMILES notation for benzyl-(chloromethyl)-methoxysilane?
The canonical SMILES for benzyl-(chloromethyl)-methoxysilane is CO[SiH](CCl)Cc1ccccc1.
What is the InChIKey of benzyl-(chloromethyl)-methoxysilane?
The InChIKey is ZPZITBKYDWTZKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClOSi/c1-11-12(8-10)7-9-5-3-2-4-6-9/h2-6,12H,7-8H2,1H3.
What are the key properties of benzyl-(chloromethyl)-methoxysilane?
benzyl-(chloromethyl)-methoxysilane has a molecular weight of 200.74 g/mol, XLogP of 1.92, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl-(chloromethyl)-methoxysilane is sourced from PubChem (CID 154313089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).