41563-69-3

Name 1,3-BENZENEDIMETHANETHIOL
CAS 41563-69-3
Molecular Formula C8H10S2
MDL Number MFCD00012311
Molecular Weight 170.29
MOL File 41563-69-3.mol
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Chemical Properties

Boiling point  168-170 °C/25 mmHg (lit.)
density  1.15 g/mL at 25 °C(lit.)
refractive index  n20/D 1.6207(lit.)
Fp  >230 °F
storage temp.  RT, stored under nitrogen
form  clear liquid
pka 9.36±0.10(Predicted)
color  Colorless to Light yellow
Specific Gravity 1.150
InChI 1S/C8H10S2/c9-5-7-2-1-3-8(4-7)6-10/h1-4,9-10H,5-6H2
InChIKey JSNABGZJVWSNOB-UHFFFAOYSA-N
SMILES SCc1cccc(CS)c1
CAS DataBase Reference 41563-69-3(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
RIDADR  UN 3334
WGK Germany  3
HS Code  2930909899
Storage Class 10 - Combustible liquids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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