2,1,3-Benzoxadiazole,4-[(3-methoxyphenyl)sulfinyl]-7-nitro-,3-oxide

CAS

53619-53-7

Catalog Number

ACM53619537

Category

Other Products

Molecular Weight

335.2921

Molecular Formula

C₁₃H₉N₃O₆S

MSDS COA Spec Sheet

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Specification

Synonyms

NSC228121, AC1L7NS5, NSC-228121, 4-(3-methoxyphenyl)sulfinyl-7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium, 53619-53-7

IUPAC Name

4-(3-methoxyphenyl)sulfinyl-7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium

Canonical SMILES

COC1=CC(=CC=C1)S(=O)C2=CC=C(C3=NO[N+](=C23)[O-])[N+](=O)[O-]

InChI Key

MAWCCVQAHUMTEL-UHFFFAOYSA-N

Boiling Point

597.8ºC at 760mmHg

Flash Point

315.4ºC

Density

1.71g/cm³

Exact Mass

335.02100

H-Bond Acceptor

H-Bond Donor

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