4,4'-Dinitro diphenyl disulfide

CAT: 0926-FD40889Size: 100 gDry Ice: NoHazardous: No

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CAT#:0926-FD40889Size:100 g

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CAS Number

100-32-3

MDL Number

MFCD00003573

Smiles

C1=CC (=CC=C1[N+] (=O) [O-]) SSC2=CC=C (C=C2) [N+] (=O) [O-]

Controlled

Chemical Information

Bis(4-nitrophenyl) disulfide

structure

CAS Number	100-32-3
PubChem CID	7496
IUPAC Name	1-nitro-4-[(4-nitrophenyl)disulfanyl]benzene
Molecular Formula	C12H8N2O4S2
Molecular Weight	308.3
XLogP	3.7
Topological Polar Surface Area	142
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Heavy Atom Count	20
Formal Charge	0
Complexity	308

SMILES

C1=CC(=CC=C1[N+](=O)[O-])SSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H8N2O4S2/c15-13(16)9-1-5-11(6-2-9)19-20-12-7-3-10(4-8-12)14(17)18/h1-8H

InChIKey

KWGZRLZJBLEVFZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 100-32-3

CID: 7496

Formula: C12H8N2O4S2

MW: 308.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	308.3
XLogP3	3.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	307.99254909
Monoisotopic Mass	307.99254909
Topological Polar Surface Area	142 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	308
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FD40111-01	Diphenyl disulfide
FD33724-01	2,2'-Dichloro diphenyl disulfide
FD00343-01	4,4'-Dinitro-2,2'-bipyridine
BAA62030	±, ±-Diphenyl-4-pyridylmethanol
FD67674-01	2,6-Dinitro-4-methylaniline
FD66933-01	2,4-Dinitro-5-methylphenylhydrazine
PAA03808-01	2,4-Dinitro-2'-methoxydiphenylamine
FD69856-01	3,5-Dinitro-4-hydroxybenzaldehyde
FD67959-01	2,4-Dinitro-5-fluorotoluene
FD67702-01	2,4-Dinitro-m-xylene

Catalog	Name
273248-01	4,4'-Dimethoxy diphenyl disulfide
447334-01	Diphenyl Disulfide
HY-Y1177R-01	Diphenyl disulfide (Standard)
D5110-01	4,4'-DIPYRIDYL DISULFIDE
sc-234783	Diphenyl-4-pyridylmethane
TRC-D492383-25MG	4,4-Diphenyl-1-piperidinepropanol
TRC-D460998-50MG	4,4'-Dimethoxy Diphenyl Sulfide
sc-277679	4,4-Diphenyl-2-butanone
sc-262204	4,4'- (Hexafluoroisopropylidene) diphenyl dimethacrylate
sc-336554	4,4'-Dichloro Diphenyl Sulfide