34-bromotetratriacontyl-chloro-dimethylsilane

C36H74BrClSi — CID 87680706

IUPAC34-bromotetratriacontyl-chloro-dimethylsilane
SMILESC[Si](C)(Cl)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCBr
InChIInChI=1S/C36H74BrClSi/c1-39(2,38)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37/h3-36H2,1-2H3
InChIKeyDYQFQPWFVKBSDK-UHFFFAOYSA-N
MW650.43 g/mol
LogP15.31
Rot. Bonds34

About 34-bromotetratriacontyl-chloro-dimethylsilane

34-bromotetratriacontyl-chloro-dimethylsilane (PubChem CID 87680706) has the molecular formula C36H74BrClSi and a molecular weight of 650.43 g/mol. Its IUPAC name is 34-bromotetratriacontyl-chloro-dimethylsilane.

Molecular Properties

Compound Name34-bromotetratriacontyl-chloro-dimethylsilane
PubChem CID87680706
Molecular FormulaC36H74BrClSi
Molecular Weight650.43 g/mol
Exact Mass648.44
IUPAC Name34-bromotetratriacontyl-chloro-dimethylsilane
SMILESC[Si](C)(Cl)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCBr
InChIInChI=1S/C36H74BrClSi/c1-39(2,38)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37/h3-36H2,1-2H3
InChIKeyDYQFQPWFVKBSDK-UHFFFAOYSA-N
XLogP15.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds34
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500650.43
LogP ≤ 515.31
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': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 34-bromotetratriacontyl-chloro-dimethylsilane?
The IUPAC name of 34-bromotetratriacontyl-chloro-dimethylsilane (CID 87680706) is 34-bromotetratriacontyl-chloro-dimethylsilane.
What is the SMILES notation for 34-bromotetratriacontyl-chloro-dimethylsilane?
The canonical SMILES for 34-bromotetratriacontyl-chloro-dimethylsilane is C[Si](C)(Cl)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCBr.
What is the InChIKey of 34-bromotetratriacontyl-chloro-dimethylsilane?
The InChIKey is DYQFQPWFVKBSDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H74BrClSi/c1-39(2,38)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37/h3-36H2,1-2H3.
What are the key properties of 34-bromotetratriacontyl-chloro-dimethylsilane?
34-bromotetratriacontyl-chloro-dimethylsilane has a molecular weight of 650.43 g/mol, XLogP of 15.31, 34 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 34-bromotetratriacontyl-chloro-dimethylsilane is sourced from PubChem (CID 87680706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).