3-(chloromethyl)pentan-3-yloxysilane

C6H15ClOSi — CID 123715774

IUPAC3-(chloromethyl)pentan-3-yloxysilane
SMILESCCC(CC)(CCl)O[SiH3]
InChIInChI=1S/C6H15ClOSi/c1-3-6(4-2,5-7)8-9/h3-5H2,1-2,9H3
InChIKeyKWEWKTOUFFDCMZ-UHFFFAOYSA-N
MW166.72 g/mol
LogP1.08
Rot. Bonds4

About 3-(chloromethyl)pentan-3-yloxysilane

3-(chloromethyl)pentan-3-yloxysilane (PubChem CID 123715774) has the molecular formula C6H15ClOSi and a molecular weight of 166.72 g/mol. Its IUPAC name is 3-(chloromethyl)pentan-3-yloxysilane.

Molecular Properties

Compound Name3-(chloromethyl)pentan-3-yloxysilane
PubChem CID123715774
Molecular FormulaC6H15ClOSi
Molecular Weight166.72 g/mol
Exact Mass166.06
IUPAC Name3-(chloromethyl)pentan-3-yloxysilane
SMILESCCC(CC)(CCl)O[SiH3]
InChIInChI=1S/C6H15ClOSi/c1-3-6(4-2,5-7)8-9/h3-5H2,1-2,9H3
InChIKeyKWEWKTOUFFDCMZ-UHFFFAOYSA-N
XLogP1.08
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.72
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

CID 23146685
CID 23146685
dichloromethane;1,1,1-trichloropropane
CID 23328703
1,1-dichloroethoxysilane
CID 123382571
3-ethylundec-10-en-3-yloxysilane
CID 173196898
17-hexadecyltetratriacontan-17-yloxysilane
CID 173060502
14-tridecyloctacosan-14-yloxysilane
CID 173060340
N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine
CID 123801657
CID 175267598
CID 175267598
[(3R)-2,2,3-trimethylpentan-3-yl]oxysilane
CID 173401924
trichloro(3-ethylpentan-3-yloxy)silane
CID 102408577
(6-chloro-4-propyloctan-4-yl)oxysilane
CID 175576062
1,1,1-trichloropropane;trihydrochloride
CID 175077591

Frequently Asked Questions

What is the IUPAC name of 3-(chloromethyl)pentan-3-yloxysilane?
The IUPAC name of 3-(chloromethyl)pentan-3-yloxysilane (CID 123715774) is 3-(chloromethyl)pentan-3-yloxysilane.
What is the SMILES notation for 3-(chloromethyl)pentan-3-yloxysilane?
The canonical SMILES for 3-(chloromethyl)pentan-3-yloxysilane is CCC(CC)(CCl)O[SiH3].
What is the InChIKey of 3-(chloromethyl)pentan-3-yloxysilane?
The InChIKey is KWEWKTOUFFDCMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15ClOSi/c1-3-6(4-2,5-7)8-9/h3-5H2,1-2,9H3.
What are the key properties of 3-(chloromethyl)pentan-3-yloxysilane?
3-(chloromethyl)pentan-3-yloxysilane has a molecular weight of 166.72 g/mol, XLogP of 1.08, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(chloromethyl)pentan-3-yloxysilane is sourced from PubChem (CID 123715774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).