butyl-iodo-methyl-phenoxysilane

C11H17IOSi — CID 154487021

IUPACbutyl-iodo-methyl-phenoxysilane
SMILESCCCC[Si](C)(I)Oc1ccccc1
InChIInChI=1S/C11H17IOSi/c1-3-4-10-14(2,12)13-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
InChIKeySIDMEAYFNKVPJR-UHFFFAOYSA-N
MW320.25 g/mol
LogP4.37
Rot. Bonds5

About butyl-iodo-methyl-phenoxysilane

butyl-iodo-methyl-phenoxysilane (PubChem CID 154487021) has the molecular formula C11H17IOSi and a molecular weight of 320.25 g/mol. Its IUPAC name is butyl-iodo-methyl-phenoxysilane.

Molecular Properties

Compound Namebutyl-iodo-methyl-phenoxysilane
PubChem CID154487021
Molecular FormulaC11H17IOSi
Molecular Weight320.25 g/mol
Exact Mass320.01
IUPAC Namebutyl-iodo-methyl-phenoxysilane
SMILESCCCC[Si](C)(I)Oc1ccccc1
InChIInChI=1S/C11H17IOSi/c1-3-4-10-14(2,12)13-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
InChIKeySIDMEAYFNKVPJR-UHFFFAOYSA-N
XLogP4.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.25
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

butyl-diiodo-phenoxysilane
CID 140745005
diiodo-octyl-phenoxysilane
CID 140744994
ethyl-diphenoxy-propylsilane
CID 140623858
4-[diethyl(phenoxy)silyl]butyl-diethyl-phenoxysilane
CID 66773415
phenoxy-diphenyl-propylsilane
CID 66773867
bromo-ethoxy-hexyl-phenoxysilane
CID 140745144
iodo-methyl-octyl-phenylsilane
CID 154486879
bromo-hexyl-phenoxy-propoxysilane
CID 140745083
butyl-[dimethyl(phenyl)silyl]oxy-dimethylsilane
CID 167313973
butyl-dimethoxy-phenylsilane
CID 66773516
butyl-dimethyl-(2-phenoxy-2-phenylethoxy)silane
CID 175703714
ethenyl-methyl-phenoxy-tridecoxysilane
CID 91743893

Frequently Asked Questions

What is the IUPAC name of butyl-iodo-methyl-phenoxysilane?
The IUPAC name of butyl-iodo-methyl-phenoxysilane (CID 154487021) is butyl-iodo-methyl-phenoxysilane.
What is the SMILES notation for butyl-iodo-methyl-phenoxysilane?
The canonical SMILES for butyl-iodo-methyl-phenoxysilane is CCCC[Si](C)(I)Oc1ccccc1.
What is the InChIKey of butyl-iodo-methyl-phenoxysilane?
The InChIKey is SIDMEAYFNKVPJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17IOSi/c1-3-4-10-14(2,12)13-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3.
What are the key properties of butyl-iodo-methyl-phenoxysilane?
butyl-iodo-methyl-phenoxysilane has a molecular weight of 320.25 g/mol, XLogP of 4.37, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-iodo-methyl-phenoxysilane is sourced from PubChem (CID 154487021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).