benzyl-dimethyl-(3-methylbut-2-enyl)silane

C14H22Si — CID 86181978

IUPACbenzyl-dimethyl-(3-methylbut-2-enyl)silane
SMILESCC(C)=CC[Si](C)(C)Cc1ccccc1
InChIInChI=1S/C14H22Si/c1-13(2)10-11-15(3,4)12-14-8-6-5-7-9-14/h5-10H,11-12H2,1-4H3
InChIKeyXMHNEALGPROPRE-UHFFFAOYSA-N
MW218.42 g/mol
LogP4.44
Rot. Bonds4

About benzyl-dimethyl-(3-methylbut-2-enyl)silane

benzyl-dimethyl-(3-methylbut-2-enyl)silane (PubChem CID 86181978) has the molecular formula C14H22Si and a molecular weight of 218.42 g/mol. Its IUPAC name is benzyl-dimethyl-(3-methylbut-2-enyl)silane.

Molecular Properties

Compound Namebenzyl-dimethyl-(3-methylbut-2-enyl)silane
PubChem CID86181978
Molecular FormulaC14H22Si
Molecular Weight218.42 g/mol
Exact Mass218.15
IUPAC Namebenzyl-dimethyl-(3-methylbut-2-enyl)silane
SMILESCC(C)=CC[Si](C)(C)Cc1ccccc1
InChIInChI=1S/C14H22Si/c1-13(2)10-11-15(3,4)12-14-8-6-5-7-9-14/h5-10H,11-12H2,1-4H3
InChIKeyXMHNEALGPROPRE-UHFFFAOYSA-N
XLogP4.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.42
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

benzyl-[4-[benzyl(dimethyl)silyl]but-2-enyl]-dimethylsilane
CID 86114708
benzyl-dihydroxy-methylsilane
CID 69074928
2-[[benzyl(dimethyl)silyl]methyl]isoindole-1,3-dione
CID 15225532
N-benzyl-3-methylbut-2-en-1-amine;hydrobromide
CID 173401181
benzyl-dimethyl-(pyrrolidin-1-ylmethyl)silane
CID 19007226
2-[benzyl(dimethyl)silyl]ethanamine;hydrochloride
CID 22399691
(2-deuterio-4-methylpent-3-enyl)benzene
CID 84820233
benzyl-(3-methylbut-2-enyl)-(trimethylsilylmethyl)sulfanium
CID 10741202
benzyl-dimethyl-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silane
CID 156634604
benzyl-fluoro-dimethylsilane
CID 11105764
benzyl(3-methylbut-2-enyl)phosphane
CID 67468071
[(Z)-3-iodobut-2-enyl]benzene
CID 166908870

Frequently Asked Questions

What is the IUPAC name of benzyl-dimethyl-(3-methylbut-2-enyl)silane?
The IUPAC name of benzyl-dimethyl-(3-methylbut-2-enyl)silane (CID 86181978) is benzyl-dimethyl-(3-methylbut-2-enyl)silane.
What is the SMILES notation for benzyl-dimethyl-(3-methylbut-2-enyl)silane?
The canonical SMILES for benzyl-dimethyl-(3-methylbut-2-enyl)silane is CC(C)=CC[Si](C)(C)Cc1ccccc1.
What is the InChIKey of benzyl-dimethyl-(3-methylbut-2-enyl)silane?
The InChIKey is XMHNEALGPROPRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22Si/c1-13(2)10-11-15(3,4)12-14-8-6-5-7-9-14/h5-10H,11-12H2,1-4H3.
What are the key properties of benzyl-dimethyl-(3-methylbut-2-enyl)silane?
benzyl-dimethyl-(3-methylbut-2-enyl)silane has a molecular weight of 218.42 g/mol, XLogP of 4.44, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl-dimethyl-(3-methylbut-2-enyl)silane is sourced from PubChem (CID 86181978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).