32-iododotriacontyl(trimethoxy)silane

C35H73IO3Si — CID 87681424

IUPAC32-iododotriacontyl(trimethoxy)silane
SMILESCO[Si](CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCI)(OC)OC
InChIInChI=1S/C35H73IO3Si/c1-37-40(38-2,39-3)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36/h4-35H2,1-3H3
InChIKeyWWUQXWUOWOOAMW-UHFFFAOYSA-N
MW696.96 g/mol
LogP13.00
Rot. Bonds35

About 32-iododotriacontyl(trimethoxy)silane

32-iododotriacontyl(trimethoxy)silane (PubChem CID 87681424) has the molecular formula C35H73IO3Si and a molecular weight of 696.96 g/mol. Its IUPAC name is 32-iododotriacontyl(trimethoxy)silane.

Molecular Properties

Compound Name32-iododotriacontyl(trimethoxy)silane
PubChem CID87681424
Molecular FormulaC35H73IO3Si
Molecular Weight696.96 g/mol
Exact Mass696.44
IUPAC Name32-iododotriacontyl(trimethoxy)silane
SMILESCO[Si](CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCI)(OC)OC
InChIInChI=1S/C35H73IO3Si/c1-37-40(38-2,39-3)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36/h4-35H2,1-3H3
InChIKeyWWUQXWUOWOOAMW-UHFFFAOYSA-N
XLogP13.00
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds35
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500696.96
LogP ≤ 513.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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': 'iodine', 'substructure': 'N/A'}

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Related Compounds

25-iodopentacosyl(trimethoxy)silane
CID 87682429
10-iododecyl(trimethoxy)silane
CID 87686313
trimethoxy(6-trimethoxysilylhexyl)silane
CID 158013726
triethoxy(14-iodotetradecyl)silane
CID 87686143
triethoxy(31-iodohentriacontyl)silane
CID 87683557
triethoxy(17-iodoheptadecyl)silane
CID 87686040
dodecyl(trimethoxy)silane;octane
CID 174570785
trimethoxy(pentacontyl)silane
CID 87930715
hexacosyl(trimethoxy)silane
CID 150262252
hexane;bis(hexyl(trimethoxy)silane)
CID 175053771
36-trimethoxysilylhexatriacontan-1-amine
CID 87680936
decyl(trimethoxy)silane;hexyl(trimethoxy)silane
CID 22665206

Frequently Asked Questions

What is the IUPAC name of 32-iododotriacontyl(trimethoxy)silane?
The IUPAC name of 32-iododotriacontyl(trimethoxy)silane (CID 87681424) is 32-iododotriacontyl(trimethoxy)silane.
What is the SMILES notation for 32-iododotriacontyl(trimethoxy)silane?
The canonical SMILES for 32-iododotriacontyl(trimethoxy)silane is CO[Si](CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCI)(OC)OC.
What is the InChIKey of 32-iododotriacontyl(trimethoxy)silane?
The InChIKey is WWUQXWUOWOOAMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H73IO3Si/c1-37-40(38-2,39-3)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36/h4-35H2,1-3H3.
What are the key properties of 32-iododotriacontyl(trimethoxy)silane?
32-iododotriacontyl(trimethoxy)silane has a molecular weight of 696.96 g/mol, XLogP of 13.00, 35 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 32-iododotriacontyl(trimethoxy)silane is sourced from PubChem (CID 87681424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).