chloro-(3-fluoropropyl)-dimethoxysilane

C5H12ClFO2Si — CID 87213749

IUPACchloro-(3-fluoropropyl)-dimethoxysilane
SMILESCO[Si](Cl)(CCCF)OC
InChIInChI=1S/C5H12ClFO2Si/c1-8-10(6,9-2)5-3-4-7/h3-5H2,1-2H3
InChIKeyHTZXKCQFLTVVTL-UHFFFAOYSA-N
MW186.69 g/mol
LogP1.82
Rot. Bonds5

About chloro-(3-fluoropropyl)-dimethoxysilane

chloro-(3-fluoropropyl)-dimethoxysilane (PubChem CID 87213749) has the molecular formula C5H12ClFO2Si and a molecular weight of 186.69 g/mol. Its IUPAC name is chloro-(3-fluoropropyl)-dimethoxysilane.

Molecular Properties

Compound Namechloro-(3-fluoropropyl)-dimethoxysilane
PubChem CID87213749
Molecular FormulaC5H12ClFO2Si
Molecular Weight186.69 g/mol
Exact Mass186.03
IUPAC Namechloro-(3-fluoropropyl)-dimethoxysilane
SMILESCO[Si](Cl)(CCCF)OC
InChIInChI=1S/C5H12ClFO2Si/c1-8-10(6,9-2)5-3-4-7/h3-5H2,1-2H3
InChIKeyHTZXKCQFLTVVTL-UHFFFAOYSA-N
XLogP1.82
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.69
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

chloro-(fluoromethyl)-dimethoxysilane
CID 150967946
[dimethyl(2-trimethoxysilylethyl)silyl]oxy-(3-fluoropropyl)-dimethylsilane
CID 176847661
chloro-ethoxy-hexyl-methoxysilane
CID 140745098
3-fluoropropyl-dimethoxy-methylsilane;1,1,2-trifluoroethene
CID 160832808
trimethoxy(6-trimethoxysilylhexyl)silane
CID 158013726
dichloro-[2-[dichloro(methoxy)silyl]ethyl]-methoxysilane
CID 87935169
3-(fluoromethoxy)propyl-trimethoxysilane
CID 58238485
tribromo(3-fluoropropyl)silane
CID 141079149
chloro-(ethoxymethyl)-dimethoxysilane
CID 151151515
28-chlorooctacosyl(trimethoxy)silane
CID 87680981
3-(3-fluoropropoxy)propyl-trimethoxysilane;fluoro(trimethoxy)methane
CID 90729153
trichloro(octadecyl)silane;trimethoxy(octadecyl)silane
CID 174467705

Frequently Asked Questions

What is the IUPAC name of chloro-(3-fluoropropyl)-dimethoxysilane?
The IUPAC name of chloro-(3-fluoropropyl)-dimethoxysilane (CID 87213749) is chloro-(3-fluoropropyl)-dimethoxysilane.
What is the SMILES notation for chloro-(3-fluoropropyl)-dimethoxysilane?
The canonical SMILES for chloro-(3-fluoropropyl)-dimethoxysilane is CO[Si](Cl)(CCCF)OC.
What is the InChIKey of chloro-(3-fluoropropyl)-dimethoxysilane?
The InChIKey is HTZXKCQFLTVVTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12ClFO2Si/c1-8-10(6,9-2)5-3-4-7/h3-5H2,1-2H3.
What are the key properties of chloro-(3-fluoropropyl)-dimethoxysilane?
chloro-(3-fluoropropyl)-dimethoxysilane has a molecular weight of 186.69 g/mol, XLogP of 1.82, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(3-fluoropropyl)-dimethoxysilane is sourced from PubChem (CID 87213749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).