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2,3-Butanedithiol Structure

2,3-Butanedithiol

Chemical Properties

Melting point -53.9°C (estimate)
Boiling point 86-87 °C/50 mmHg (lit.)
Density  0.995 g/mL at 25 °C (lit.)
vapor density  >1 (vs air)
FEMA  3477 | 2,3-BUTANEDITHIOL
refractive index  n20/D 1.5194(lit.)
Flash point 126 °F
form  liquid (estimate)
pka 9.93±0.10(Predicted)
Specific Gravity 0.995
color  Colorless to Light yellow to Light orange
Odor at 0.10 % in propylene glycol. meaty beefy
Odor Type sulfurous
biological source synthetic
JECFA Number 539
Major Application flavors and fragrances
InChI 1S/C4H10S2/c1-3(5)4(2)6/h3-6H,1-2H3
InChIKey TWWSEEHCVDRRRI-UHFFFAOYSA-N
SMILES CC(S)C(C)S
LogP 2.004 (est)
CAS DataBase Reference 4532-64-3(CAS DataBase Reference)
EPA Substance Registry System 2,3-Butanedithiol (4532-64-3)

Safety Information

Hazard Codes  Xn
Risk Statements  10-22-36/37/38
Safety Statements  16-26
RIDADR  UN 3336 3/PG 3
WGK Germany  3
TSCA  TSCA listed
HazardClass  3.2
PackingGroup  III
HS Code  29309090
Storage Class 3 - Flammable liquids
Hazard Classifications Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
STOT SE 3

MSDS

Usage And Synthesis

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