Butyl(dichloro){3-[(2-chloroethyl)(methyl)silyl]propyl}silane

C10H22Cl3Si2 — CID 78060478

IUPAC—
SMILESCCCC[Si](Cl)(Cl)CCC[Si](C)CCCl
InChIInChI=1S/C10H22Cl3Si2/c1-3-4-9-15(12,13)10-5-7-14(2)8-6-11/h3-10H2,1-2H3
InChIKeyWIOQCMOKQUNHFT-UHFFFAOYSA-N
MW304.82 g/mol
LogP5.46
Rot. Bonds9

About Butyl(dichloro){3-[(2-chloroethyl)(methyl)silyl]propyl}silane

Butyl(dichloro){3-[(2-chloroethyl)(methyl)silyl]propyl}silane (PubChem CID 78060478) has the molecular formula C10H22Cl3Si2 and a molecular weight of 304.82 g/mol.

Molecular Properties

Compound NameButyl(dichloro){3-[(2-chloroethyl)(methyl)silyl]propyl}silane
PubChem CID78060478
Molecular FormulaC10H22Cl3Si2
Molecular Weight304.82 g/mol
Exact Mass303.03
IUPAC Name—
SMILESCCCC[Si](Cl)(Cl)CCC[Si](C)CCCl
InChIInChI=1S/C10H22Cl3Si2/c1-3-4-9-15(12,13)10-5-7-14(2)8-6-11/h3-10H2,1-2H3
InChIKeyWIOQCMOKQUNHFT-UHFFFAOYSA-N
XLogP5.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.82
LogP ≤ 55.46
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'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

Dibutyl-chloro-(3-chloropropyl)silane
CID 19956785
Tert-butyl-chloro-(3-chloropropyl)-methylsilane
CID 23362574
Butyl-chloro-(3-chloropropyl)-methylsilane
CID 57285915
Chloro-[[di(propan-2-yl)-lambda3-chloranyl]-oxosilyl]-di(propan-2-yl)silane
CID 59795776
Butyl-[2-[butyl(chloromethyl)silyl]ethyl]-(chloromethyl)silane
CID 71325957
2,2-Dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane
CID 123506218
Butyl-(2-chloroethyl)-propylsilane
CID 123776832
2-Chloroethyl-propan-2-yl-propylsilane
CID 123882873
Dichloro-bis(3-chlorobutyl)silane
CID 142627782
Chloro-[2-(2,2-dichloroethylsilyl)ethyl]-diethylsilane
CID 149765810
Chloro-(3-chloropropyl)-ethyl-propylsilane
CID 152268595
Bis(2-chloro-2-dimethylsilylethyl)-dimethylsilane
CID 154175240

Frequently Asked Questions

What is the IUPAC name of Butyl(dichloro){3-[(2-chloroethyl)(methyl)silyl]propyl}silane?
The IUPAC name of Butyl(dichloro){3-[(2-chloroethyl)(methyl)silyl]propyl}silane (CID 78060478) is not available.
What is the SMILES notation for Butyl(dichloro){3-[(2-chloroethyl)(methyl)silyl]propyl}silane?
The canonical SMILES for Butyl(dichloro){3-[(2-chloroethyl)(methyl)silyl]propyl}silane is CCCC[Si](Cl)(Cl)CCC[Si](C)CCCl.
What is the InChIKey of Butyl(dichloro){3-[(2-chloroethyl)(methyl)silyl]propyl}silane?
The InChIKey is WIOQCMOKQUNHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22Cl3Si2/c1-3-4-9-15(12,13)10-5-7-14(2)8-6-11/h3-10H2,1-2H3.
What are the key properties of Butyl(dichloro){3-[(2-chloroethyl)(methyl)silyl]propyl}silane?
Butyl(dichloro){3-[(2-chloroethyl)(methyl)silyl]propyl}silane has a molecular weight of 304.82 g/mol, XLogP of 5.46, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Butyl(dichloro){3-[(2-chloroethyl)(methyl)silyl]propyl}silane is sourced from PubChem (CID 78060478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).