4-METHYLPHENYL ISOTHIOCYANATE

CAS No.
622-59-3
CCD No.
CCD00004632
Formula
C8 H7 N S
MolWeight
149.216

Basic Information

Product Name: 4-METHYLPHENYL ISOTHIOCYANATE
CAS: 622-59-3
English Synonyms: 1-ISOTHIOCYANATO-4-METHYLBENZENE ; P-TOLYL ISOTHIOCYANATE ; 4-METHYLPHENYL ISOTHIOCYANATE ; ISOTHIOCYANIC ACID P-TOLYL ESTER ; BENZENE, 1-ISOTHIOCYANATO-4-METHYL- ; 4-TOLYL ISOTHIOCYANATE ; ISOTHIOCYANIC ACID 4-METHYLPHENYL ESTER
MDL Number.: MFCD00004813
H bond acceptor: 1
H bond donor: 0
Smile: Cc1ccc(cc1)N=C=S
InChi: InChI=1S/C8H7NS/c1-7-2-4-8(5-3-7)9-6-10/h2-5H,1H3
InChiKey: InChIKey=ABQKHKWXTUVKGF-UHFFFAOYSA-N

Property

Melting Point: 25-26 DEG C(LIT)
Boiling Point: 62 DEG C/0.3 MMHG(LIT)
Physical Property: FLASHPOINT: 107 DEG C
FLASHPOINT: 224.6 DEG F
REFRACTIVE INDEX: N20/D 1.6345(LIT)
Comments: RIDADR: UN 2811 6.1/PG 2
RTECS: NX9500000
UNSPSC: 12352100
WGK: 3

Safety information

Symbol: GHS07 GHS07 GHS08 GHS08
Signal word: Danger
Hazard statements: H315-H317-H319-H334-H335
Precautionary statements: P261-P280-P305 + P351 + P338-P342 + P311
hazard symbol: Xn
Risk Code: R:36/37/38-42
Safe Code: S:22-26-36
WGK Germany: 3

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