3-NITROPHENACYL THIOCYANATE

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Catalog Number

ACM6097229

Product Name

Structure

CAS

6097-22-9

Category

Heterocyclic Organic Compound

Synonyms

Oprea1_691942, MolPort-001-757-820, ZINC02388859, CID5031676, KA-0704, 6097-22-9

IUPAC Name

[2-(3-nitrophenyl)-2-oxoethyl] thiocyanate

Molecular Weight

222.22

Molecular Formula

C9H6N2O3S

Canonical SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)CSC#N

InChI Key

ABKJWLHODKUEJA-UHFFFAOYSA-N

Boiling Point

377.5ºC at 760 mmHg

Melting Point

124-126ºC

Flash Point

182.1ºC

Density

1.418 g/cm³

Exact Mass

222.01000

Hazard Statements

H-Bond Acceptor

H-Bond Donor

MSDS

COA

Spec Sheet

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