CAS 6421-04-1 Diethyl Azoxybenzene-4,4'-dicarboxylate

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Diethyl Azoxybenzene-4,4'-dicarboxylate

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Catalog Number

ACM6421041-1

CAS Number

6421-04-1

Product Name

Diethyl Azoxybenzene-4,4'-dicarboxylate

Structure

Category

Liquid Crystal (LC) Building Blocks; Liquid Crystal (LC) Materials

Synonyms

Azoxybenzene-4,4'-dicarboxylic Acid Diethyl Ester

IUPAC Name

(4-ethoxycarbonylphenyl)-(4-ethoxycarbonylphenyl)imino-oxidoazanium

Molecular Weight

342.35

Molecular Formula

C18H18N2O5

Canonical SMILES

CCOC(=O)C1=CC=C(C=C1)N=[N+](C2=CC=C(C=C2)C(=O)OCC)[O-]

InChI

InChI=1S/C18H18N2O5/c1-3-24-17(21)13-5-9-15(10-6-13)19-20(23)16-11-7-14(8-12-16)18(22)25-4-2/h5-12H,3-4H2,1-2H3

InChI Key

LOOVRYZFUGHEMF-UHFFFAOYSA-N

Melting Point

97-130 ºC

Purity

97%+

Appearance

Light orange to Yellow to Green powder to crystal

Complexity

478

Covalently-Bonded Unit Count

EC Number

229-169-0

Exact Mass

342.121572g/mol

Formal Charge

Heavy Atom Count

MDL Number

MFCD00053758

Monoisotopic Mass

342.121572g/mol

NSC Number

680513;401032

Rotatable Bond Count

XLogP3

3.6

MSDS

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COA

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Spec Sheet

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