3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane

C8H18Cl4Si2 — CID 123410454

IUPAC3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane
SMILESClC(Cl)CC[SiH2]CC[SiH2]CCC(Cl)Cl
InChIInChI=1S/C8H18Cl4Si2/c9-7(10)1-3-13-5-6-14-4-2-8(11)12/h7-8H,1-6,13-14H2
InChIKeyYPMUUROVNXLCKM-UHFFFAOYSA-N
MW312.22 g/mol
LogP3.38
Rot. Bonds9

About 3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane

3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane (PubChem CID 123410454) has the molecular formula C8H18Cl4Si2 and a molecular weight of 312.22 g/mol. Its IUPAC name is 3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane.

Molecular Properties

Compound Name3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane
PubChem CID123410454
Molecular FormulaC8H18Cl4Si2
Molecular Weight312.22 g/mol
Exact Mass309.97
IUPAC Name3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane
SMILESClC(Cl)CC[SiH2]CC[SiH2]CCC(Cl)Cl
InChIInChI=1S/C8H18Cl4Si2/c9-7(10)1-3-13-5-6-14-4-2-8(11)12/h7-8H,1-6,13-14H2
InChIKeyYPMUUROVNXLCKM-UHFFFAOYSA-N
XLogP3.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.22
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,1,6,6-tetrachlorohexane
CID 87407260
2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane
CID 123506218
1,1-dichloro-3-methylsulfanylpropane
CID 119095673
22,22-dichlorodocosyl(methyl)silane
CID 170842182
10,10-dichlorodecyl(methyl)silane
CID 57370743
(3,3-Dichloropropyl)silane
CID 57000949
3,3-bis[(2-methylpropan-2-yl)oxy]propyl-[2-[3,3-bis[(2-methylpropan-2-yl)oxy]propylsilyl]ethyl]silane
CID 123812229
10,10-dichlorodecyl(2-methylbutyl)silane
CID 71352918
1,4,4-trichlorobutan-1-ol
CID 140995909
2-(2,2-dichloroethylsilyl)ethyl-trimethylsilane
CID 71389556
CID 87144547
CID 87144547
1,1-dichloro-4-fluorobutane
CID 22321169

Frequently Asked Questions

What is the IUPAC name of 3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane?
The IUPAC name of 3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane (CID 123410454) is 3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane.
What is the SMILES notation for 3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane?
The canonical SMILES for 3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane is ClC(Cl)CC[SiH2]CC[SiH2]CCC(Cl)Cl.
What is the InChIKey of 3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane?
The InChIKey is YPMUUROVNXLCKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18Cl4Si2/c9-7(10)1-3-13-5-6-14-4-2-8(11)12/h7-8H,1-6,13-14H2.
What are the key properties of 3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane?
3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane has a molecular weight of 312.22 g/mol, XLogP of 3.38, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane is sourced from PubChem (CID 123410454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).