622-59-3

Name 4-Methylphenyl isothiocyanate
CAS 622-59-3
EINECS(EC#) 210-745-5
Molecular Formula C8H7NS
MDL Number MFCD00004813
Molecular Weight 149.21
MOL File 622-59-3.mol
show more

Chemical Properties

Appearance clear light yellow liquid after melting
Melting point  25-26 °C (lit.)
Boiling point  237 °C (lit.) 62 °C/0.3 mmHg (lit.)
density  1.1442 (rough estimate)
refractive index  n20/D 1.6345(lit.)
Fp  107 °C
storage temp.  Store below +30°C.
form  powder to lump
color  White to Light yellow
Water Solubility  MAY DECOMPOSE
Sensitive  Moisture Sensitive
BRN  386032
InChI InChI=1S/C8H7NS/c1-7-2-4-8(5-3-7)9-6-10/h2-5H,1H3
InChIKey ABQKHKWXTUVKGF-UHFFFAOYSA-N
SMILES C1(N=C=S)=CC=C(C)C=C1
CAS DataBase Reference 622-59-3(CAS DataBase Reference)
NIST Chemistry Reference Benzene, 1-isothiocyanato-4-methyl-(622-59-3)

Safety Data

Hazard Codes  Xn,T
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
R42:May cause sensitization by inhalation.
R42/43:May cause sensitization by inhalation and skin contact .
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
Safety Statements 
S22:Do not breathe dust .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
RIDADR  UN 2811 6.1/PG 2
WGK Germany  3
RTECS  NX9500000
F  10-21
HazardClass  6.1
PackingGroup  III
HS Code  29309090
Storage Class 6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
Hazard Classifications Eye Irrit. 2
Resp. Sens. 1
Skin Irrit. 2
Skin Sens. 1
STOT SE 3

Hazard Information

Spectrum Detail

Well-known Reagent Company Product Information

Supplier

Related Products

Send Inquriy