dichloromethyl(4-phenylbut-3-enyl)silane

C11H14Cl2Si — CID 131722819

IUPACdichloromethyl(4-phenylbut-3-enyl)silane
SMILESClC(Cl)[SiH2]CCC=Cc1ccccc1
InChIInChI=1S/C11H14Cl2Si/c12-11(13)14-9-5-4-8-10-6-2-1-3-7-10/h1-4,6-8,11H,5,9,14H2
InChIKeyQUXQCBRCHOFAPR-UHFFFAOYSA-N
MW245.23 g/mol
LogP3.44
Rot. Bonds5

About dichloromethyl(4-phenylbut-3-enyl)silane

dichloromethyl(4-phenylbut-3-enyl)silane (PubChem CID 131722819) has the molecular formula C11H14Cl2Si and a molecular weight of 245.23 g/mol. Its IUPAC name is dichloromethyl(4-phenylbut-3-enyl)silane.

Molecular Properties

Compound Namedichloromethyl(4-phenylbut-3-enyl)silane
PubChem CID131722819
Molecular FormulaC11H14Cl2Si
Molecular Weight245.23 g/mol
Exact Mass244.02
IUPAC Namedichloromethyl(4-phenylbut-3-enyl)silane
SMILESClC(Cl)[SiH2]CCC=Cc1ccccc1
InChIInChI=1S/C11H14Cl2Si/c12-11(13)14-9-5-4-8-10-6-2-1-3-7-10/h1-4,6-8,11H,5,9,14H2
InChIKeyQUXQCBRCHOFAPR-UHFFFAOYSA-N
XLogP3.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.23
LogP ≤ 53.44
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

ethenyl-[[ethenyl(dimethyl)silyl]oxy-(4-phenylbut-3-enylsilyl)methoxy]-dimethylsilane
CID 123564848
4-chloropent-1-enylbenzene
CID 66808272
[(1E)-5-phenylpenta-1,4-dienyl]benzene
CID 91021368
chloro(3-phenylprop-2-enyl)silane
CID 154264872
ethane;[(E)-pent-1-enyl]benzene
CID 143265687
(E)-5-phenylpent-4-enal
CID 11105652
chloro-diphenyl-(3-phenylprop-2-enyl)phosphanium
CID 173397693
[(E)-1-chloro-4-phenylbut-3-enyl]benzene
CID 13252853
triphenyl-[(E)-4-phenylbut-3-enyl]phosphanium
CID 15529550
dichloro-[(E)-5-phenylpent-4-enylidene]ruthenium
CID 23519266
[(E)-3-chloroprop-1-enyl]benzene;hydron
CID 174539817
[(E)-5-iodopent-1-enyl]benzene
CID 87330563

Frequently Asked Questions

What is the IUPAC name of dichloromethyl(4-phenylbut-3-enyl)silane?
The IUPAC name of dichloromethyl(4-phenylbut-3-enyl)silane (CID 131722819) is dichloromethyl(4-phenylbut-3-enyl)silane.
What is the SMILES notation for dichloromethyl(4-phenylbut-3-enyl)silane?
The canonical SMILES for dichloromethyl(4-phenylbut-3-enyl)silane is ClC(Cl)[SiH2]CCC=Cc1ccccc1.
What is the InChIKey of dichloromethyl(4-phenylbut-3-enyl)silane?
The InChIKey is QUXQCBRCHOFAPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14Cl2Si/c12-11(13)14-9-5-4-8-10-6-2-1-3-7-10/h1-4,6-8,11H,5,9,14H2.
What are the key properties of dichloromethyl(4-phenylbut-3-enyl)silane?
dichloromethyl(4-phenylbut-3-enyl)silane has a molecular weight of 245.23 g/mol, XLogP of 3.44, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromethyl(4-phenylbut-3-enyl)silane is sourced from PubChem (CID 131722819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).