4946-13-8

Name 4-ETHYLTHIOPHENOL
CAS 4946-13-8
EINECS(EC#) 670-930-5
Molecular Formula C8H10S
MDL Number MFCD00040229
Molecular Weight 138.23
MOL File 4946-13-8.mol
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Chemical Properties

Melting point  -30°C (estimate)
Boiling point  119 °C
density  1.02
refractive index  1.563
Fp  119-120°C/30mm
storage temp.  2-8°C, stored under nitrogen
form  liquid
pka 6.84±0.10(Predicted)
color  Clear, colourless
Sensitive  Air Sensitive
BRN  1905734
InChI InChI=1S/C8H10S/c1-2-7-3-5-8(9)6-4-7/h3-6,9H,2H2,1H3
InChIKey WWQQPHUHTAZWDH-UHFFFAOYSA-N
SMILES C1(S)=CC=C(CC)C=C1
LogP 3.510 (est)
CAS DataBase Reference 4946-13-8(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Skull and Crossbones (GHS06)
GHS06
Signal word  Danger
Hazard statements  H302-H312-H315-H319-H331-H335
Precautionary statements  P261-P280-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes  Xi
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
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 .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
RIDADR  2810
HazardClass  6.1
HazardClass  IRRITANT, AIR SENSITIVE, STENCH
HS Code  29309090

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