(3-chloro-2-methylpropyl)-(dimethoxymethyl)silane

C7H17ClO2Si — CID 57370781

IUPAC(3-chloro-2-methylpropyl)-(dimethoxymethyl)silane
SMILESCOC(OC)[SiH2]CC(C)CCl
InChIInChI=1S/C7H17ClO2Si/c1-6(4-8)5-11-7(9-2)10-3/h6-7H,4-5,11H2,1-3H3
InChIKeyGCBIXQRJGXYXFE-UHFFFAOYSA-N
MW196.75 g/mol
LogP1.02
Rot. Bonds6

About (3-chloro-2-methylpropyl)-(dimethoxymethyl)silane

(3-chloro-2-methylpropyl)-(dimethoxymethyl)silane (PubChem CID 57370781) has the molecular formula C7H17ClO2Si and a molecular weight of 196.75 g/mol. Its IUPAC name is (3-chloro-2-methylpropyl)-(dimethoxymethyl)silane.

Molecular Properties

Compound Name(3-chloro-2-methylpropyl)-(dimethoxymethyl)silane
PubChem CID57370781
Molecular FormulaC7H17ClO2Si
Molecular Weight196.75 g/mol
Exact Mass196.07
IUPAC Name(3-chloro-2-methylpropyl)-(dimethoxymethyl)silane
SMILESCOC(OC)[SiH2]CC(C)CCl
InChIInChI=1S/C7H17ClO2Si/c1-6(4-8)5-11-7(9-2)10-3/h6-7H,4-5,11H2,1-3H3
InChIKeyGCBIXQRJGXYXFE-UHFFFAOYSA-N
XLogP1.02
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.75
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3-chloro-2-methylpropyl)-(dimethoxymethyl)silane?
The IUPAC name of (3-chloro-2-methylpropyl)-(dimethoxymethyl)silane (CID 57370781) is (3-chloro-2-methylpropyl)-(dimethoxymethyl)silane.
What is the SMILES notation for (3-chloro-2-methylpropyl)-(dimethoxymethyl)silane?
The canonical SMILES for (3-chloro-2-methylpropyl)-(dimethoxymethyl)silane is COC(OC)[SiH2]CC(C)CCl.
What is the InChIKey of (3-chloro-2-methylpropyl)-(dimethoxymethyl)silane?
The InChIKey is GCBIXQRJGXYXFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17ClO2Si/c1-6(4-8)5-11-7(9-2)10-3/h6-7H,4-5,11H2,1-3H3.
What are the key properties of (3-chloro-2-methylpropyl)-(dimethoxymethyl)silane?
(3-chloro-2-methylpropyl)-(dimethoxymethyl)silane has a molecular weight of 196.75 g/mol, XLogP of 1.02, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-2-methylpropyl)-(dimethoxymethyl)silane is sourced from PubChem (CID 57370781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).