dichloro-methyl-(3,3,3-trifluoropropyl)silane

C8H14Cl4F6Si2 — CID 159011444

IUPACdichloro-methyl-(3,3,3-trifluoropropyl)silane
SMILESC[Si](Cl)(Cl)CCC(F)(F)F.C[Si](Cl)(Cl)CCC(F)(F)F
InChIInChI=1S/2C4H7Cl2F3Si/c2*1-10(5,6)3-2-4(7,8)9/h2*2-3H2,1H3
InChIKeyJSNQZWSEJFNHOE-UHFFFAOYSA-N
MW422.17 g/mol
LogP6.98
Rot. Bonds4

About dichloro-methyl-(3,3,3-trifluoropropyl)silane

dichloro-methyl-(3,3,3-trifluoropropyl)silane (PubChem CID 159011444) has the molecular formula C8H14Cl4F6Si2 and a molecular weight of 422.17 g/mol. Its IUPAC name is dichloro-methyl-(3,3,3-trifluoropropyl)silane.

Molecular Properties

Compound Namedichloro-methyl-(3,3,3-trifluoropropyl)silane
PubChem CID159011444
Molecular FormulaC8H14Cl4F6Si2
Molecular Weight422.17 g/mol
Exact Mass419.93
IUPAC Namedichloro-methyl-(3,3,3-trifluoropropyl)silane
SMILESC[Si](Cl)(Cl)CCC(F)(F)F.C[Si](Cl)(Cl)CCC(F)(F)F
InChIInChI=1S/2C4H7Cl2F3Si/c2*1-10(5,6)3-2-4(7,8)9/h2*2-3H2,1H3
InChIKeyJSNQZWSEJFNHOE-UHFFFAOYSA-N
XLogP6.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.17
LogP ≤ 56.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze dichloro-methyl-(3,3,3-trifluoropropyl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

dichloro-methyl-(3,3,3-trifluoropropyl)silane
CID 12666
dimethyl-bis(3,3,3-trifluoropropyl)silane
CID 139788750
dichloro-methyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-nonadecafluoroundecyl)silane
CID 101217112
dichloro-(1,1,2,2,5,5,5-heptafluoropentyl)-methylsilane
CID 88685115
trifluoro(3,3,3-trifluoropropyl)silane
CID 10976113
methane;trimethyl-[methyl-(3,3,3-trifluoropropyl)-trimethylsilyloxysilyl]oxysilane
CID 158893063
dichloro-(5-chloro-3,3,5-trimethylhexyl)-methylsilane
CID 11425849
N-[dimethyl(3,3,3-trifluoropropyl)silyl]-N-ethylethanamine
CID 102443994
chloro-dimethyl-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silane;dichloro-methyl-(3,3,3-trifluoropropyl)silane;3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl(trimethoxy)silane;trichloro(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)silane;trichloro(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silane;trichloro(3,3,3-trifluoropropyl)silane;triethoxy(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)silane;triethoxy(3,3,4,4,5,5,6,6,6-nonafluorohexyl)silane;triethoxy(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silane;trimethoxy(3,3,4,4,5,5,6,6,6-nonafluorohexyl)silane;trimethoxy(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silane
CID 164956203
bis[[[dimethyl(3,3,3-trifluoropropyl)silyl]oxy-methyl-(3,3,3-trifluoropropyl)silyl]oxy]-methyl-(3,3,3-trifluoropropyl)silane
CID 141318833
hydroxy-dimethyl-(4,4,4-trifluorobutyl)silane
CID 140692013
dichloro-methyl-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16-octacosafluorooctadec-17-enyl)silane;trichloro(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16-octacosafluorooctadec-17-enyl)silane
CID 91593862

Frequently Asked Questions

What is the IUPAC name of dichloro-methyl-(3,3,3-trifluoropropyl)silane?
The IUPAC name of dichloro-methyl-(3,3,3-trifluoropropyl)silane (CID 159011444) is dichloro-methyl-(3,3,3-trifluoropropyl)silane.
What is the SMILES notation for dichloro-methyl-(3,3,3-trifluoropropyl)silane?
The canonical SMILES for dichloro-methyl-(3,3,3-trifluoropropyl)silane is C[Si](Cl)(Cl)CCC(F)(F)F.C[Si](Cl)(Cl)CCC(F)(F)F.
What is the InChIKey of dichloro-methyl-(3,3,3-trifluoropropyl)silane?
The InChIKey is JSNQZWSEJFNHOE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H7Cl2F3Si/c2*1-10(5,6)3-2-4(7,8)9/h2*2-3H2,1H3.
What are the key properties of dichloro-methyl-(3,3,3-trifluoropropyl)silane?
dichloro-methyl-(3,3,3-trifluoropropyl)silane has a molecular weight of 422.17 g/mol, XLogP of 6.98, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-methyl-(3,3,3-trifluoropropyl)silane is sourced from PubChem (CID 159011444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).