(1,3-dibromoazulen-2-yl)-trimethylsilane

C13H14Br2Si — CID 11175760

IUPAC(1,3-dibromoazulen-2-yl)-trimethylsilane
SMILESC[Si](C)(C)c1c(Br)c2cccccc-2c1Br
InChIInChI=1S/C13H14Br2Si/c1-16(2,3)13-11(14)9-7-5-4-6-8-10(9)12(13)15/h4-8H,1-3H3
InChIKeyJWOSPMJBJCNLRE-UHFFFAOYSA-N
MW358.15 g/mol
LogP4.86
Rot. Bonds1

About (1,3-dibromoazulen-2-yl)-trimethylsilane

(1,3-dibromoazulen-2-yl)-trimethylsilane (PubChem CID 11175760) has the molecular formula C13H14Br2Si and a molecular weight of 358.15 g/mol. Its IUPAC name is (1,3-dibromoazulen-2-yl)-trimethylsilane.

Molecular Properties

Compound Name(1,3-dibromoazulen-2-yl)-trimethylsilane
PubChem CID11175760
Molecular FormulaC13H14Br2Si
Molecular Weight358.15 g/mol
Exact Mass355.92
IUPAC Name(1,3-dibromoazulen-2-yl)-trimethylsilane
SMILESC[Si](C)(C)c1c(Br)c2cccccc-2c1Br
InChIInChI=1S/C13H14Br2Si/c1-16(2,3)13-11(14)9-7-5-4-6-8-10(9)12(13)15/h4-8H,1-3H3
InChIKeyJWOSPMJBJCNLRE-UHFFFAOYSA-N
XLogP4.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.15
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-[3-(2-aminophenyl)-2-trimethylsilylphenyl]aniline
CID 154709030
2-bromo-1-[2-(2-bromo-3-methylphenyl)phenyl]-3-methylbenzene
CID 147690466
(1,3-dibromoazulen-2-yl)-diphenylphosphane
CID 102277157
2-amino-3-bromoazulene-1-carbonitrile
CID 101482931
tetramethylsilane;trimethyl(phenyl)silane
CID 161005748
(2-bromo-6-iodophenyl)-trimethylsilane
CID 11279692
N-[chloro(dimethyl)silyl]aniline
CID 18000043
magnesium;trimethyl(phenyl)silane;dibromide
CID 175580992
trimethyl-(2-trimethylsilylphenyl)silane
CID 519794
bromo(113C)cyclohexatriene
CID 11094888
bromo(413C)cyclohexatriene
CID 66995401
[(1S,4S)-2,3-di(fluoren-9-ylidene)-4-trimethylsilylcyclobutyl]-trimethylsilane
CID 16723468

Frequently Asked Questions

What is the IUPAC name of (1,3-dibromoazulen-2-yl)-trimethylsilane?
The IUPAC name of (1,3-dibromoazulen-2-yl)-trimethylsilane (CID 11175760) is (1,3-dibromoazulen-2-yl)-trimethylsilane.
What is the SMILES notation for (1,3-dibromoazulen-2-yl)-trimethylsilane?
The canonical SMILES for (1,3-dibromoazulen-2-yl)-trimethylsilane is C[Si](C)(C)c1c(Br)c2cccccc-2c1Br.
What is the InChIKey of (1,3-dibromoazulen-2-yl)-trimethylsilane?
The InChIKey is JWOSPMJBJCNLRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14Br2Si/c1-16(2,3)13-11(14)9-7-5-4-6-8-10(9)12(13)15/h4-8H,1-3H3.
What are the key properties of (1,3-dibromoazulen-2-yl)-trimethylsilane?
(1,3-dibromoazulen-2-yl)-trimethylsilane has a molecular weight of 358.15 g/mol, XLogP of 4.86, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1,3-dibromoazulen-2-yl)-trimethylsilane is sourced from PubChem (CID 11175760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).