1-chlorohexyl-dimethyl-phenylsilane

C14H23ClSi — CID 14984372

IUPAC1-chlorohexyl-dimethyl-phenylsilane
SMILESCCCCCC(Cl)[Si](C)(C)c1ccccc1
InChIInChI=1S/C14H23ClSi/c1-4-5-7-12-14(15)16(2,3)13-10-8-6-9-11-13/h6,8-11,14H,4-5,7,12H2,1-3H3
InChIKeySCTSFRMOBCREAY-UHFFFAOYSA-N
MW254.88 g/mol
LogP4.33
Rot. Bonds6

About 1-chlorohexyl-dimethyl-phenylsilane

1-chlorohexyl-dimethyl-phenylsilane (PubChem CID 14984372) has the molecular formula C14H23ClSi and a molecular weight of 254.88 g/mol. Its IUPAC name is 1-chlorohexyl-dimethyl-phenylsilane.

Molecular Properties

Compound Name1-chlorohexyl-dimethyl-phenylsilane
PubChem CID14984372
Molecular FormulaC14H23ClSi
Molecular Weight254.88 g/mol
Exact Mass254.13
IUPAC Name1-chlorohexyl-dimethyl-phenylsilane
SMILESCCCCCC(Cl)[Si](C)(C)c1ccccc1
InChIInChI=1S/C14H23ClSi/c1-4-5-7-12-14(15)16(2,3)13-10-8-6-9-11-13/h6,8-11,14H,4-5,7,12H2,1-3H3
InChIKeySCTSFRMOBCREAY-UHFFFAOYSA-N
XLogP4.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.88
LogP ≤ 54.33
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

(2S)-2-[dimethyl(phenyl)silyl]hexan-1-ol
CID 10752326
[(1S)-1-[(3S,4R,7R,8S)-7-[(1S)-1-[dimethyl(phenyl)silyl]heptyl]-4,8-dimethyl-2,2,6,6-tetraphenyl-1,5,2,6-dioxadisilocan-3-yl]heptyl]-dimethyl-phenylsilane
CID 102351538
[dihexyl(phenyl)silyl]-dihexyl-phenylsilane
CID 12059876
chloro-methyl-octyl-phenylsilane
CID 66989770
decyl-methyl-diphenylsilane
CID 15259590
dihexyl-methyl-phenylsilane
CID 71342172
dichloro-heptyl-phenylsilane
CID 101161411
icosyl-dimethyl-phenylsilane
CID 91054385
oct-1-en-3-yl(triphenyl)silane
CID 154720363
N-[1-[dimethyl(phenyl)silyl]octyl]-2-methoxypropanamide
CID 10545759
butan-2-yl-dimethyl-phenylsilane
CID 102005826
chloroform;heptane;toluene
CID 70374828

Frequently Asked Questions

What is the IUPAC name of 1-chlorohexyl-dimethyl-phenylsilane?
The IUPAC name of 1-chlorohexyl-dimethyl-phenylsilane (CID 14984372) is 1-chlorohexyl-dimethyl-phenylsilane.
What is the SMILES notation for 1-chlorohexyl-dimethyl-phenylsilane?
The canonical SMILES for 1-chlorohexyl-dimethyl-phenylsilane is CCCCCC(Cl)[Si](C)(C)c1ccccc1.
What is the InChIKey of 1-chlorohexyl-dimethyl-phenylsilane?
The InChIKey is SCTSFRMOBCREAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23ClSi/c1-4-5-7-12-14(15)16(2,3)13-10-8-6-9-11-13/h6,8-11,14H,4-5,7,12H2,1-3H3.
What are the key properties of 1-chlorohexyl-dimethyl-phenylsilane?
1-chlorohexyl-dimethyl-phenylsilane has a molecular weight of 254.88 g/mol, XLogP of 4.33, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chlorohexyl-dimethyl-phenylsilane is sourced from PubChem (CID 14984372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).