Dapsone Impurity 21

CAT: 1299-RM-D011621-03Size: 50 mgDry Ice: NoHazardous: No

1 / 1

CAT#:1299-RM-D011621-03Size:50 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

1141-88-4

Synonyms

2,2'-disulfanediyldianiline

Molecular Formula

C12H12N2S2

Molecular Weight

248.36

Target Alternative Name

Dapsone

Product Name Synonym

2,2'-disulfanediyldianiline

Chemical Information

Bis(2-aminophenyl) disulfide

resin hardener

CAS Number	1141-88-4
PubChem CID	14358
IUPAC Name	2-[(2-aminophenyl)disulfanyl]aniline
Molecular Formula	C12H12N2S2
Molecular Weight	248.4
XLogP	3.1
Topological Polar Surface Area	103
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	16
Formal Charge	0
Complexity	191

SMILES

C1=CC=C(C(=C1)N)SSC2=CC=CC=C2N

InChI

InChI=1S/C12H12N2S2/c13-9-5-1-3-7-11(9)15-16-12-8-4-2-6-10(12)14/h1-8H,13-14H2

InChIKey

YYYOQURZQWIILK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1141-88-4

CID: 14358

Formula: C12H12N2S2

MW: 248.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	248.4
XLogP3	3.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	248.04419074
Monoisotopic Mass	248.04419074
Topological Polar Surface Area	103 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	191
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