3,6-dichlorohexan-2-ylsilane

C6H14Cl2Si — CID 173228280

IUPAC3,6-dichlorohexan-2-ylsilane
SMILESCC([SiH3])C(Cl)CCCCl
InChIInChI=1S/C6H14Cl2Si/c1-5(9)6(8)3-2-4-7/h5-6H,2-4H2,1,9H3
InChIKeySYTNAPLEWXHOPI-UHFFFAOYSA-N
MW185.17 g/mol
LogP1.79
Rot. Bonds4

About 3,6-dichlorohexan-2-ylsilane

3,6-dichlorohexan-2-ylsilane (PubChem CID 173228280) has the molecular formula C6H14Cl2Si and a molecular weight of 185.17 g/mol. Its IUPAC name is 3,6-dichlorohexan-2-ylsilane.

Molecular Properties

Compound Name3,6-dichlorohexan-2-ylsilane
PubChem CID173228280
Molecular FormulaC6H14Cl2Si
Molecular Weight185.17 g/mol
Exact Mass184.02
IUPAC Name3,6-dichlorohexan-2-ylsilane
SMILESCC([SiH3])C(Cl)CCCCl
InChIInChI=1S/C6H14Cl2Si/c1-5(9)6(8)3-2-4-7/h5-6H,2-4H2,1,9H3
InChIKeySYTNAPLEWXHOPI-UHFFFAOYSA-N
XLogP1.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.17
LogP ≤ 51.79
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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Related Compounds

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CID 175347315
1,5,6,7,8,9-hexachlorodecane
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1,5-dichlorononane
CID 57182000
(2S)-5-chloropentan-2-ol
CID 12659782
1-chloro-4-methylhexadecane
CID 88652760
1-chlorobutane;chloroform
CID 88838918
3-chloro-2-methylheptane
CID 523767
(2R)-5-chloro-N-methylpentan-2-amine
CID 129120324
1,1,2,3,7-pentachloroheptane
CID 90233122
1-chloropentane;2-methylpropane
CID 174338226
1,1-dichloroethane;1,2-dichloroethane;hexane
CID 175301802
bis(1,1-dichloroethane);bis(1,2-dichloroethane)
CID 175329145

Frequently Asked Questions

What is the IUPAC name of 3,6-dichlorohexan-2-ylsilane?
The IUPAC name of 3,6-dichlorohexan-2-ylsilane (CID 173228280) is 3,6-dichlorohexan-2-ylsilane.
What is the SMILES notation for 3,6-dichlorohexan-2-ylsilane?
The canonical SMILES for 3,6-dichlorohexan-2-ylsilane is CC([SiH3])C(Cl)CCCCl.
What is the InChIKey of 3,6-dichlorohexan-2-ylsilane?
The InChIKey is SYTNAPLEWXHOPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14Cl2Si/c1-5(9)6(8)3-2-4-7/h5-6H,2-4H2,1,9H3.
What are the key properties of 3,6-dichlorohexan-2-ylsilane?
3,6-dichlorohexan-2-ylsilane has a molecular weight of 185.17 g/mol, XLogP of 1.79, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dichlorohexan-2-ylsilane is sourced from PubChem (CID 173228280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).