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Structure

Benzene,2-isothiocyanato-1-methoxy-4-nitro-

CAS
71793-51-6
Catalog Number
ACM71793516
Category
Other Products
Molecular Weight
210.21
Molecular Formula
C8H6N2O3S

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Specification

Synonyms
2-Isothiocyanato-1-methoxy-4-nitrobenzene, 2-Methoxy-5-nitrophenylisothiocyanate, MolPort-000-156-851, STK502592, ZINC02528185, ALBB-003094, CID522431, 71793-51-6
IUPAC Name
2-isothiocyanato-1-methoxy-4-nitrobenzene
Canonical SMILES
COC1=C(C=C(C=C1)[N+](=O)[O-])N=C=S
InChI Key
QVOHAYVRNBCJDV-UHFFFAOYSA-N
Boiling Point
388.1ºC at 760 mmHg
Melting Point
105ºC
Flash Point
188.5ºC
Density
1.33g/cm³
Exact Mass
210.01000
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
4
H-Bond Donor
0
Safety Description
26-36/37/39
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