benzyl-chloro-dimethylsilane

C9H13ClSi — CID 15780

IUPACbenzyl-chloro-dimethylsilane
SMILESC[Si](C)(Cl)Cc1ccccc1
InChIInChI=1S/C9H13ClSi/c1-11(2,10)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKeyABHNFDUSOVXXOA-UHFFFAOYSA-N
MW184.74 g/mol
LogP3.21
Rot. Bonds2

About benzyl-chloro-dimethylsilane

benzyl-chloro-dimethylsilane (PubChem CID 15780) has the molecular formula C9H13ClSi and a molecular weight of 184.74 g/mol. Its IUPAC name is benzyl-chloro-dimethylsilane.

Molecular Properties

Compound Namebenzyl-chloro-dimethylsilane
PubChem CID15780
Molecular FormulaC9H13ClSi
Molecular Weight184.74 g/mol
Exact Mass184.05
IUPAC Namebenzyl-chloro-dimethylsilane
SMILESC[Si](C)(Cl)Cc1ccccc1
InChIInChI=1S/C9H13ClSi/c1-11(2,10)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKeyABHNFDUSOVXXOA-UHFFFAOYSA-N
XLogP3.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.74
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Toluene
CID 1140
Alpha-Methylstyrene
CID 7407
Ethylbenzene
CID 7500
Styrene
CID 7501
P-Xylene
CID 7809
Butylbenzene
CID 7705
1-Ethenyl-4-methylbenzene
CID 12161
Propylbenzene
CID 7668
Allylbenzene
CID 9309
trans-beta-METHYLSTYRENE
CID 252325
Dichloromethylphenylsilane
CID 9006
Ethylphenyldichlorosilane
CID 14304

Frequently Asked Questions

What is the IUPAC name of benzyl-chloro-dimethylsilane?
The IUPAC name of benzyl-chloro-dimethylsilane (CID 15780) is benzyl-chloro-dimethylsilane.
What is the SMILES notation for benzyl-chloro-dimethylsilane?
The canonical SMILES for benzyl-chloro-dimethylsilane is C[Si](C)(Cl)Cc1ccccc1.
What is the InChIKey of benzyl-chloro-dimethylsilane?
The InChIKey is ABHNFDUSOVXXOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClSi/c1-11(2,10)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3.
What are the key properties of benzyl-chloro-dimethylsilane?
benzyl-chloro-dimethylsilane has a molecular weight of 184.74 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl-chloro-dimethylsilane is sourced from PubChem (CID 15780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).