(4-chlorophenyl) thiohypobromite

C6H4BrClS — CID 12623145

IUPAC(4-chlorophenyl) thiohypobromite
SMILESClc1ccc(SBr)cc1
InChIInChI=1S/C6H4BrClS/c7-9-6-3-1-5(8)2-4-6/h1-4H
InChIKeyUKAGSGSUVSYCMD-UHFFFAOYSA-N
MW223.52 g/mol
LogP3.74
Rot. Bonds1

About (4-chlorophenyl) thiohypobromite

(4-chlorophenyl) thiohypobromite (PubChem CID 12623145) has the molecular formula C6H4BrClS and a molecular weight of 223.52 g/mol. Its IUPAC name is (4-chlorophenyl) thiohypobromite.

Molecular Properties

Compound Name(4-chlorophenyl) thiohypobromite
PubChem CID12623145
Molecular FormulaC6H4BrClS
Molecular Weight223.52 g/mol
Exact Mass221.89
IUPAC Name(4-chlorophenyl) thiohypobromite
SMILESClc1ccc(SBr)cc1
InChIInChI=1S/C6H4BrClS/c7-9-6-3-1-5(8)2-4-6/h1-4H
InChIKeyUKAGSGSUVSYCMD-UHFFFAOYSA-N
XLogP3.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.52
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

azane;1,4-dichlorobenzene
CID 69330361
1-chloro-4-(dichloromethylsulfanyl)benzene
CID 15869632
bis[(4-chlorophenyl)sulfanyl]phosphinic acid
CID 11142675
1-chloro-4-ethylsulfanylbenzene
CID 5324154
1-chloro-4-[3-(4-chlorophenyl)sulfanylpropylsulfanyl]benzene
CID 12836424
1-bromo-4-chlorobenzene
CID 7806
bis[(4-chlorophenyl)sulfanyl]phosphinic acid;hydrochloride
CID 70448717
3,4-bis[(4-chlorophenyl)sulfanyl]cyclobut-3-ene-1,2-dione
CID 606826
1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)sulfanylethenyl]sulfanylbenzene
CID 13156717
(4-chlorophenyl)sulfanyl acetate
CID 139466888
1-chloro-4-(1,2,2-trichloropropylsulfanyl)benzene
CID 13419823
1,4-dichlorobenzene;trichloroalumane
CID 174756083

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl) thiohypobromite?
The IUPAC name of (4-chlorophenyl) thiohypobromite (CID 12623145) is (4-chlorophenyl) thiohypobromite.
What is the SMILES notation for (4-chlorophenyl) thiohypobromite?
The canonical SMILES for (4-chlorophenyl) thiohypobromite is Clc1ccc(SBr)cc1.
What is the InChIKey of (4-chlorophenyl) thiohypobromite?
The InChIKey is UKAGSGSUVSYCMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrClS/c7-9-6-3-1-5(8)2-4-6/h1-4H.
What are the key properties of (4-chlorophenyl) thiohypobromite?
(4-chlorophenyl) thiohypobromite has a molecular weight of 223.52 g/mol, XLogP of 3.74, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl) thiohypobromite is sourced from PubChem (CID 12623145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).