[3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane

C13H23ClSi2 — CID 137330700

IUPAC[3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane
SMILESCc1cc([SiH](C)CCCl)cc([Si](C)(C)C)c1
InChIInChI=1S/C13H23ClSi2/c1-11-8-12(15(2)7-6-14)10-13(9-11)16(3,4)5/h8-10,15H,6-7H2,1-5H3
InChIKeyKBNBHLMAVNCACL-UHFFFAOYSA-N
MW270.95 g/mol
LogP2.84
Rot. Bonds4

About [3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane

[3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane (PubChem CID 137330700) has the molecular formula C13H23ClSi2 and a molecular weight of 270.95 g/mol. Its IUPAC name is [3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane.

Molecular Properties

Compound Name[3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane
PubChem CID137330700
Molecular FormulaC13H23ClSi2
Molecular Weight270.95 g/mol
Exact Mass270.10
IUPAC Name[3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane
SMILESCc1cc([SiH](C)CCCl)cc([Si](C)(C)C)c1
InChIInChI=1S/C13H23ClSi2/c1-11-8-12(15(2)7-6-14)10-13(9-11)16(3,4)5/h8-10,15H,6-7H2,1-5H3
InChIKeyKBNBHLMAVNCACL-UHFFFAOYSA-N
XLogP2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.95
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane?
The IUPAC name of [3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane (CID 137330700) is [3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane.
What is the SMILES notation for [3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane?
The canonical SMILES for [3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane is Cc1cc([SiH](C)CCCl)cc([Si](C)(C)C)c1.
What is the InChIKey of [3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane?
The InChIKey is KBNBHLMAVNCACL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23ClSi2/c1-11-8-12(15(2)7-6-14)10-13(9-11)16(3,4)5/h8-10,15H,6-7H2,1-5H3.
What are the key properties of [3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane?
[3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane has a molecular weight of 270.95 g/mol, XLogP of 2.84, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[2-chloroethyl(methyl)silyl]-5-methylphenyl]-trimethylsilane is sourced from PubChem (CID 137330700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).