4-chlorobut-1-ene;propylsilane

C7H17ClSi — CID 174687261

IUPAC4-chlorobut-1-ene;propylsilane
SMILESC=CCCCl.CCC[SiH3]
InChIInChI=1S/C4H7Cl.C3H10Si/c1-2-3-4-5;1-2-3-4/h2H,1,3-4H2;2-3H2,1,4H3
InChIKeyVIPGXVZZMMFWTM-UHFFFAOYSA-N
MW164.75 g/mol
LogP1.98
Rot. Bonds3

About 4-chlorobut-1-ene;propylsilane

4-chlorobut-1-ene;propylsilane (PubChem CID 174687261) has the molecular formula C7H17ClSi and a molecular weight of 164.75 g/mol. Its IUPAC name is 4-chlorobut-1-ene;propylsilane.

Molecular Properties

Compound Name4-chlorobut-1-ene;propylsilane
PubChem CID174687261
Molecular FormulaC7H17ClSi
Molecular Weight164.75 g/mol
Exact Mass164.08
IUPAC Name4-chlorobut-1-ene;propylsilane
SMILESC=CCCCl.CCC[SiH3]
InChIInChI=1S/C4H7Cl.C3H10Si/c1-2-3-4-5;1-2-3-4/h2H,1,3-4H2;2-3H2,1,4H3
InChIKeyVIPGXVZZMMFWTM-UHFFFAOYSA-N
XLogP1.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.75
LogP ≤ 51.98
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': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-chlorobut-1-ene;N,N-dimethylmethanamine;hydrochloride
CID 173093257
(111C)pent-1-ene
CID 177423582
CID 175109121
CID 175109121
butane;ethene;pent-1-ene
CID 177174553
ethane;pent-1-ene;propane
CID 162735255
propylsilane;silane
CID 161307657
but-1-ene;ethene;pent-1-ene
CID 140771113
hex-1-ene;zinc
CID 174554611
hex-5-enylsilane
CID 15905503
octadec-1-ene;tetradec-1-ene
CID 158470925
hex-1-ene;zirconium(4+);dichloride
CID 157382882
non-1-ene
CID 141296734

Frequently Asked Questions

What is the IUPAC name of 4-chlorobut-1-ene;propylsilane?
The IUPAC name of 4-chlorobut-1-ene;propylsilane (CID 174687261) is 4-chlorobut-1-ene;propylsilane.
What is the SMILES notation for 4-chlorobut-1-ene;propylsilane?
The canonical SMILES for 4-chlorobut-1-ene;propylsilane is C=CCCCl.CCC[SiH3].
What is the InChIKey of 4-chlorobut-1-ene;propylsilane?
The InChIKey is VIPGXVZZMMFWTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7Cl.C3H10Si/c1-2-3-4-5;1-2-3-4/h2H,1,3-4H2;2-3H2,1,4H3.
What are the key properties of 4-chlorobut-1-ene;propylsilane?
4-chlorobut-1-ene;propylsilane has a molecular weight of 164.75 g/mol, XLogP of 1.98, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chlorobut-1-ene;propylsilane is sourced from PubChem (CID 174687261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).