Skip to the beginning of the images gallery

Bis(4-nitrophenyl) Sulfide - >99.0%(HPLC), high purity , CAS No.1223-31-0

COA

Grade & Purity:

≥99%(HPLC)

Cas Number: 1223-31-0
Molecular Weight: 276.27
MDL number: MFCD00039745
PubChem CID: 14655
PubChem SID: 504752577

In stock

Item Number

B152345

Grouped product items
SKU	Size	Availability	Price
B152345-1g	1g	2	$15.90
B152345-5g	5g	2	$58.90
B152345-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$152.90
B152345-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$547.90

View related series

Nitrogenous compounds (2445) Non heterocyclic block (8163)

Basic Description

Synonyms	Benzene,1'-thiobis[4-nitro- \| 4,4'-Dinitrophenylsulfide \| Hydroxy(4-((4-(hydroxy(oxido)amino)phenyl)thio)phenyl)azane oxide \| 1-nitro-4-[(4-nitrophenyl)thio]benzene \| di(p-Nitrophenyl) sulfide \| EN300-17123 \| AS-60187 \| ZZTJMQPRKBNGNX-UHFFFAOYSA- \| dinitr
Specifications & Purity	≥99%(HPLC)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organosulfur compounds
  - Class Thioethers
    - Subclass Aryl thioethers

Kingdom	Organic compounds
Superclass	Organosulfur compounds
Class	Thioethers
Subclass	Aryl thioethers
Intermediate Tree Nodes	Not available
Direct Parent	Diarylthioethers
Alternative Parents	Nitrobenzenes Thiophenol ethers Nitroaromatic compounds Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Diarylthioether - Nitrobenzene - Nitroaromatic compound - Thiophenol ether - Monocyclic benzene moiety - Benzenoid - C-nitro compound - Organic nitro compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as diarylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two aryl groups.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504752577
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504752577
IUPAC Name	1-nitro-4-(4-nitrophenyl)sulfanylbenzene
INCHI	InChI=1S/C12H8N2O4S/c15-13(16)9-1-5-11(6-2-9)19-12-7-3-10(4-8-12)14(17)18/h1-8H
InChIKey	ZZTJMQPRKBNGNX-UHFFFAOYSA-N
Smiles	C1=CC(=CC=C1[N+](=O)[O-])SC2=CC=C(C=C2)[N+](=O)[O-]
Isomeric SMILES	C1=CC(=CC=C1[N+](=O)[O-])SC2=CC=C(C=C2)[N+](=O)[O-]
RTECS	WQ2150000
Molecular Weight	276.27
Reaxy-Rn	2058966
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2058966&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number	Certificate Type	Date	Item
G2127068	Certificate of Analysis	May 12, 2025	B152345
G2127069	Certificate of Analysis	May 07, 2025	B152345
G2127070	Certificate of Analysis	May 07, 2025	B152345
C2201123	Certificate of Analysis	Jan 22, 2022	B152345
C2201126	Certificate of Analysis	Jan 22, 2022	B152345
C2201340	Certificate of Analysis	Jan 22, 2022	B152345

Chemical and Physical Properties

Solubility	soluble in acetone
Melt Point(°C)	159.0 - 162.0 °C
Molecular Weight	276.270 g/mol
XLogP3	3.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	276.02 Da
Monoisotopic Mass	276.02 Da
Topological Polar Surface Area	117.000 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	294.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration