2-chloropropyl-dimethyl-prop-2-enylsilane

C8H17ClSi — CID 14041193

IUPAC2-chloropropyl-dimethyl-prop-2-enylsilane
SMILESC=CC[Si](C)(C)CC(C)Cl
InChIInChI=1S/C8H17ClSi/c1-5-6-10(3,4)7-8(2)9/h5,8H,1,6-7H2,2-4H3
InChIKeyNUBBGJWARYFTIW-UHFFFAOYSA-N
MW176.76 g/mol
LogP3.51
Rot. Bonds4

About 2-chloropropyl-dimethyl-prop-2-enylsilane

2-chloropropyl-dimethyl-prop-2-enylsilane (PubChem CID 14041193) has the molecular formula C8H17ClSi and a molecular weight of 176.76 g/mol. Its IUPAC name is 2-chloropropyl-dimethyl-prop-2-enylsilane.

Molecular Properties

Compound Name2-chloropropyl-dimethyl-prop-2-enylsilane
PubChem CID14041193
Molecular FormulaC8H17ClSi
Molecular Weight176.76 g/mol
Exact Mass176.08
IUPAC Name2-chloropropyl-dimethyl-prop-2-enylsilane
SMILESC=CC[Si](C)(C)CC(C)Cl
InChIInChI=1S/C8H17ClSi/c1-5-6-10(3,4)7-8(2)9/h5,8H,1,6-7H2,2-4H3
InChIKeyNUBBGJWARYFTIW-UHFFFAOYSA-N
XLogP3.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.76
LogP ≤ 53.51
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloropropyl-dimethyl-prop-2-enylsilane?
The IUPAC name of 2-chloropropyl-dimethyl-prop-2-enylsilane (CID 14041193) is 2-chloropropyl-dimethyl-prop-2-enylsilane.
What is the SMILES notation for 2-chloropropyl-dimethyl-prop-2-enylsilane?
The canonical SMILES for 2-chloropropyl-dimethyl-prop-2-enylsilane is C=CC[Si](C)(C)CC(C)Cl.
What is the InChIKey of 2-chloropropyl-dimethyl-prop-2-enylsilane?
The InChIKey is NUBBGJWARYFTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17ClSi/c1-5-6-10(3,4)7-8(2)9/h5,8H,1,6-7H2,2-4H3.
What are the key properties of 2-chloropropyl-dimethyl-prop-2-enylsilane?
2-chloropropyl-dimethyl-prop-2-enylsilane has a molecular weight of 176.76 g/mol, XLogP of 3.51, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloropropyl-dimethyl-prop-2-enylsilane is sourced from PubChem (CID 14041193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).