4-NITROPHENYL ISOTHIOCYANATE

CAS No.
2131-61-5
CCD No.
CCD00007010
Formula
C7 H4 N2 O2 S
MolWeight
180.187

Basic Information

Product Name: 4-NITROPHENYL ISOTHIOCYANATE
CAS: 2131-61-5
English Synonyms: P-NITROPHENYL ISOTHIOCYANATE ; BENZENE, 1-ISOTHIOCYANATO-4-NITRO- ; ISOTHIOCYANIC ACID 4-NITROPHENYL ESTER ; 1-ISOTHIOCYANATO-4-NITROBENZENE ; 4-NITROPHENYL ISOTHIOCYANATE
MDL Number.: MFCD00007307
H bond acceptor: 4
H bond donor: 0
Smile: c1cc(ccc1N=C=S)[N+](=O)[O-]
InChi: InChI=1S/C7H4N2O2S/c10-9(11)7-3-1-6(2-4-7)8-5-12/h1-4H
InChiKey: InChIKey=NXHSSIGRWJENBH-UHFFFAOYSA-N

Property

Melting Point: 110-112 DEG C(LIT)
Boiling Point: 137-138 DEG C/11 MMHG(LIT)
Comments: 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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