(1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane

C14H29IOSi — CID 54141571

IUPAC(1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane
SMILESCCCCCCC(C)(CC=CI)O[Si](C)(C)C
InChIInChI=1S/C14H29IOSi/c1-6-7-8-9-11-14(2,12-10-13-15)16-17(3,4)5/h10,13H,6-9,11-12H2,1-5H3
InChIKeyOBMAYYBFUZCFAV-UHFFFAOYSA-N
MW368.38 g/mol
LogP5.91
Rot. Bonds9

About (1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane

(1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane (PubChem CID 54141571) has the molecular formula C14H29IOSi and a molecular weight of 368.38 g/mol. Its IUPAC name is (1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane.

Molecular Properties

Compound Name(1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane
PubChem CID54141571
Molecular FormulaC14H29IOSi
Molecular Weight368.38 g/mol
Exact Mass368.10
IUPAC Name(1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane
SMILESCCCCCCC(C)(CC=CI)O[Si](C)(C)C
InChIInChI=1S/C14H29IOSi/c1-6-7-8-9-11-14(2,12-10-13-15)16-17(3,4)5/h10,13H,6-9,11-12H2,1-5H3
InChIKeyOBMAYYBFUZCFAV-UHFFFAOYSA-N
XLogP5.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.38
LogP ≤ 55.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane?
The IUPAC name of (1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane (CID 54141571) is (1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane.
What is the SMILES notation for (1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane?
The canonical SMILES for (1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane is CCCCCCC(C)(CC=CI)O[Si](C)(C)C.
What is the InChIKey of (1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane?
The InChIKey is OBMAYYBFUZCFAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29IOSi/c1-6-7-8-9-11-14(2,12-10-13-15)16-17(3,4)5/h10,13H,6-9,11-12H2,1-5H3.
What are the key properties of (1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane?
(1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane has a molecular weight of 368.38 g/mol, XLogP of 5.91, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-iodo-4-methyldec-1-en-4-yl)oxy-trimethylsilane is sourced from PubChem (CID 54141571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).