chloro(1-chlorobutyl)silane

C4H10Cl2Si — CID 175339235

IUPACchloro(1-chlorobutyl)silane
SMILESCCCC(Cl)[SiH2]Cl
InChIInChI=1S/C4H10Cl2Si/c1-2-3-4(5)7-6/h4H,2-3,7H2,1H3
InChIKeyPKVMPWVTSBOQLC-UHFFFAOYSA-N
MW157.12 g/mol
LogP1.67
Rot. Bonds3

About chloro(1-chlorobutyl)silane

chloro(1-chlorobutyl)silane (PubChem CID 175339235) has the molecular formula C4H10Cl2Si and a molecular weight of 157.12 g/mol. Its IUPAC name is chloro(1-chlorobutyl)silane.

Molecular Properties

Compound Namechloro(1-chlorobutyl)silane
PubChem CID175339235
Molecular FormulaC4H10Cl2Si
Molecular Weight157.12 g/mol
Exact Mass155.99
IUPAC Namechloro(1-chlorobutyl)silane
SMILESCCCC(Cl)[SiH2]Cl
InChIInChI=1S/C4H10Cl2Si/c1-2-3-4(5)7-6/h4H,2-3,7H2,1H3
InChIKeyPKVMPWVTSBOQLC-UHFFFAOYSA-N
XLogP1.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.12
LogP ≤ 51.67
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'}

Analyze chloro(1-chlorobutyl)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

pentan-2-ylsulfanium chloride
CID 172855201
1-chloro-N-methylbutan-1-amine
CID 22396140
(2R)-N-chloropentan-2-amine
CID 88575991
dichloro(1-chlorobutyl)silane
CID 130655013
CID 150721526
CID 150721526
chloro(pentan-3-yl)silane
CID 154053773
2,5-dichlorooctane
CID 56987607
1-chloro-1-(1-chlorobutylsulfonyl)butane
CID 88536433
1-chloro-N-phosphanylbutan-1-amine
CID 88930419
1-chloro-1-nitrosobutane
CID 91441735
1,2,5-trichlorooctane
CID 20749063
4-chloro-3-methylheptane
CID 54215050

Frequently Asked Questions

What is the IUPAC name of chloro(1-chlorobutyl)silane?
The IUPAC name of chloro(1-chlorobutyl)silane (CID 175339235) is chloro(1-chlorobutyl)silane.
What is the SMILES notation for chloro(1-chlorobutyl)silane?
The canonical SMILES for chloro(1-chlorobutyl)silane is CCCC(Cl)[SiH2]Cl.
What is the InChIKey of chloro(1-chlorobutyl)silane?
The InChIKey is PKVMPWVTSBOQLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10Cl2Si/c1-2-3-4(5)7-6/h4H,2-3,7H2,1H3.
What are the key properties of chloro(1-chlorobutyl)silane?
chloro(1-chlorobutyl)silane has a molecular weight of 157.12 g/mol, XLogP of 1.67, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(1-chlorobutyl)silane is sourced from PubChem (CID 175339235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).