Bis(2-aminophenyl) disulfide

C₁₂H₁₂N₂S₂CAS 1141-88-4248.36 g/mol

Open in Covalent MOL file

Disulfide Primary amine

Properties

Molecular formula: C₁₂H₁₂N₂S₂
Molar mass: 248.36 g/mol
Exact mass: 248.0442 Da
Melting point: 89–91 °C
logP: 3.65Crippen estimate
Polar surface area: 52.0 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 3

Hazards

Danger

H301 Toxic if swallowed56.8% of notifiers
H302 Harmful if swallowed40% of notifiers
H315 Causes skin irritation54.7% of notifiers
H317 May cause an allergic skin reaction38.9% of notifiers
H318 Causes serious eye damage98.9% of notifiers
H400 Very toxic to aquatic life57.9% of notifiers
H410 Very toxic to aquatic life with long lasting effects58.9% of notifiers
H411 Toxic to aquatic life with long lasting effects38.9% of notifiers

Aggregated from 95 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P272, P273, P280, P301+P316, P301+P317, P302+P352, P305+P354+P338, P317, P321, P330, P332+P317, P333+P317, P362+P364, P391, P405, P501

Identifiers

CAS number

1141-88-4

SMILES

Nc1ccccc1SSc1ccccc1N

InChIKey

YYYOQURZQWIILK-UHFFFAOYSA-N

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

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

23 names · show all

Benzenamine, 2,2′-dithiobis-
Aniline, 2,2′-dithiodi-
2,2′-Dithiobis[benzenamine]
Bis(o-aminophenyl) disulfide
Intramine
2,2′-Dithiodianiline
Disulfide, bis(2-aminophenyl)
2,2′-Diaminodiphenyl disulfide
o,o′-Diaminodiphenyl disulfide
2,2′-Dithiobis[aniline]
NSC 8186
Di(2-aminophenyl) disulfide
1,1′-Dithiobis(2-aminobenzene)
Di(o-aminophenyl) disulfide
NSC 54509
NSC 677450
D 1246
2,2′-Disulfidediyldianiline
Thulium ionophore I
2,2′-Disulfanediyldianiline
[2-[(2-Aminophenyl)dithio]phenyl]amine
2,2′-Dianilino disulfide
2-[(2-Aminophenyl)disulfanyl]aniline

Work with Bis(2-aminophenyl) disulfide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-(Methylthio)aniline2987-53-361 % similar 2-[(Trifluoromethyl)thio]benzenamine347-55-754 % similar Benzenamine, 2-(phenylthio)-, hydrochloride (1:1)6764-13-252 % similar 2-[(4-Chlorophenyl)thio]benzenamine37750-29-148 % similar 2-Bromoaniline615-36-143 % similar 2-Aminothiophenol137-07-542 % similar 2-Fluoroaniline348-54-942 % similar 2-Iodoaniline615-43-042 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Aminophenyl disulfide722-27-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook