chloromethyl-pent-4-enyl-phenylsilane

C12H17ClSi — CID 151394657

IUPACchloromethyl-pent-4-enyl-phenylsilane
SMILESC=CCCC[SiH](CCl)c1ccccc1
InChIInChI=1S/C12H17ClSi/c1-2-3-7-10-14(11-13)12-8-5-4-6-9-12/h2,4-6,8-9,14H,1,3,7,10-11H2
InChIKeyOVERCFNEBABRBF-UHFFFAOYSA-N
MW224.81 g/mol
LogP2.86
Rot. Bonds6

About chloromethyl-pent-4-enyl-phenylsilane

chloromethyl-pent-4-enyl-phenylsilane (PubChem CID 151394657) has the molecular formula C12H17ClSi and a molecular weight of 224.81 g/mol. Its IUPAC name is chloromethyl-pent-4-enyl-phenylsilane.

Molecular Properties

Compound Namechloromethyl-pent-4-enyl-phenylsilane
PubChem CID151394657
Molecular FormulaC12H17ClSi
Molecular Weight224.81 g/mol
Exact Mass224.08
IUPAC Namechloromethyl-pent-4-enyl-phenylsilane
SMILESC=CCCC[SiH](CCl)c1ccccc1
InChIInChI=1S/C12H17ClSi/c1-2-3-7-10-14(11-13)12-8-5-4-6-9-12/h2,4-6,8-9,14H,1,3,7,10-11H2
InChIKeyOVERCFNEBABRBF-UHFFFAOYSA-N
XLogP2.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.81
LogP ≤ 52.86
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

bis(chloromethyl)-(4-phenylphenyl)silane
CID 172792369
pent-4-enoxy(diphenyl)silane
CID 154128744
triphenyl(undec-10-enyl)phosphanium
CID 3716115
1-bromohex-5-enylbenzene
CID 13296849
oct-7-enyl(triphenyl)phosphanium bromide
CID 22627871
pent-4-enylsulfinylbenzene
CID 15893040
chloro-pent-4-enyl-triphenyl-λ5-phosphane
CID 156636022
hex-1-ene;toluene
CID 22480689
hept-6-enylbenzene
CID 15608161
1-chlorohex-5-enylsulfonylbenzene
CID 14785129
2-phenyldec-9-en-1-amine
CID 107010668
dec-9-en-1-ol;phenylmethanol
CID 159433557

Frequently Asked Questions

What is the IUPAC name of chloromethyl-pent-4-enyl-phenylsilane?
The IUPAC name of chloromethyl-pent-4-enyl-phenylsilane (CID 151394657) is chloromethyl-pent-4-enyl-phenylsilane.
What is the SMILES notation for chloromethyl-pent-4-enyl-phenylsilane?
The canonical SMILES for chloromethyl-pent-4-enyl-phenylsilane is C=CCCC[SiH](CCl)c1ccccc1.
What is the InChIKey of chloromethyl-pent-4-enyl-phenylsilane?
The InChIKey is OVERCFNEBABRBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClSi/c1-2-3-7-10-14(11-13)12-8-5-4-6-9-12/h2,4-6,8-9,14H,1,3,7,10-11H2.
What are the key properties of chloromethyl-pent-4-enyl-phenylsilane?
chloromethyl-pent-4-enyl-phenylsilane has a molecular weight of 224.81 g/mol, XLogP of 2.86, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethyl-pent-4-enyl-phenylsilane is sourced from PubChem (CID 151394657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).