3-CARBOXYPHENYL ISOTHIOCYANATE

CAS No.
2131-63-7
CCD No.
CCD00027231
Formula
C8 H5 N O2 S
MolWeight
179.199

Basic Information

Product Name: 3-CARBOXYPHENYL ISOTHIOCYANATE
CAS: 2131-63-7
English Synonyms: 3-ISOTHIOCYANATOBENZOIC ACID ; 3-CARBOXYPHENYL ISOTHIOCYANATE
MDL Number.: MFCD00041367
H bond acceptor: 3
H bond donor: 1
Smile: c1cc(cc(c1)N=C=S)C(=O)O
InChi: InChI=1S/C8H5NO2S/c10-8(11)6-2-1-3-7(4-6)9-5-12/h1-4H,(H,10,11)
InChiKey: InChIKey=PJRBPKOOGLKPFB-UHFFFAOYSA-N

Property

Melting Point: APPROX 165 DEG C DEC
Comments: BRN: 2209003
CORROSIVE/HARMFUL
EINECS: 000-000-0
HAZARD: R 20/21/22-34
HAZARD: S 26-36/37/39-45
SENSITIVITY: MOISTURE SENSITIVE
UN NUMBER: UN2923

Safety information

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