bromo(triphenyl)-λ4-sulfane

C18H15BrS — CID 12749591

IUPACbromo(triphenyl)-λ4-sulfane
SMILESBrS(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H15BrS/c19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H
InChIKeyQZEKYWWAOLSROR-UHFFFAOYSA-N
MW343.29 g/mol
LogP6.28
Rot. Bonds3

About bromo(triphenyl)-λ4-sulfane

bromo(triphenyl)-λ4-sulfane (PubChem CID 12749591) has the molecular formula C18H15BrS and a molecular weight of 343.29 g/mol. Its IUPAC name is bromo(triphenyl)-λ4-sulfane.

Molecular Properties

Compound Namebromo(triphenyl)-λ4-sulfane
PubChem CID12749591
Molecular FormulaC18H15BrS
Molecular Weight343.29 g/mol
Exact Mass342.01
IUPAC Namebromo(triphenyl)-λ4-sulfane
SMILESBrS(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H15BrS/c19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H
InChIKeyQZEKYWWAOLSROR-UHFFFAOYSA-N
XLogP6.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.29
LogP ≤ 56.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Diphenyl sulfide
CID 8766
Diphenyl sulfoxide
CID 13679
Benzene, 1,1'-(1,2-ethanediylbis(thio))bis-
CID 69317
Thianthrene
CID 7109
1,1'-(Methylenebis(thio))bis(benzene)
CID 77097
4,4'-Thiobisbenzenethiol
CID 619483
S,S-Diphenylsulfilimine
CID 608422
Phosphine, tris(p-methylthiophenyl)-
CID 207408
Arsenotrithious acid triphenyl ester
CID 193333
Tris(phenylthio)methane
CID 615706
S,S-Diphenylsulfilimine Monohydrate
CID 11435938
Triphenylsulfonium chloride
CID 61343

Frequently Asked Questions

What is the IUPAC name of bromo(triphenyl)-λ4-sulfane?
The IUPAC name of bromo(triphenyl)-λ4-sulfane (CID 12749591) is bromo(triphenyl)-λ4-sulfane.
What is the SMILES notation for bromo(triphenyl)-λ4-sulfane?
The canonical SMILES for bromo(triphenyl)-λ4-sulfane is BrS(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of bromo(triphenyl)-λ4-sulfane?
The InChIKey is QZEKYWWAOLSROR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15BrS/c19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H.
What are the key properties of bromo(triphenyl)-λ4-sulfane?
bromo(triphenyl)-λ4-sulfane has a molecular weight of 343.29 g/mol, XLogP of 6.28, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromo(triphenyl)-λ4-sulfane is sourced from PubChem (CID 12749591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).