ChemicalBook--->CAS DataBase List--->621-18-1

621-18-1

621-18-1 Structure

621-18-1 Structure
IdentificationBack Directory
[Name]

3,3'-AZODIBENZOIC ACID
[CAS]

621-18-1
[Synonyms]

AZOBENZENE-3,
3,3'-AZODIBENZOIC ACID
AZOBENZENE-3,3'-DICARBOXYLIC ACID
AZONENZENE-3,3'-DICARBOXYLIC ACID
3,3'-(Diazene-1,2-diyl)dibenzoic acid
[Molecular Formula]

C14H10N2O4
[MDL Number]

MFCD03844759
[MOL File]

621-18-1.mol
[Molecular Weight]

270.24
Chemical PropertiesBack Directory
[Melting point ]

170-171 °C
[Boiling point ]

561.4±35.0 °C(Predicted)
[density ]

1.35±0.1 g/cm3(Predicted)
[storage temp. ]

Store at room temperature
[form ]

powder to crystal
[pka]

3.54±0.10(Predicted)
[color ]

Light yellow to Brown
[InChI]

InChI=1S/C14H10N2O4/c17-13(18)9-3-1-5-11(7-9)15-16-12-6-2-4-10(8-12)14(19)20/h1-8H,(H,17,18)(H,19,20)
[InChIKey]

QBVIXYABUQQSRY-FOCLMDBBSA-N
[SMILES]

N(C1C=CC=C(C=1)C(O)=O)=NC1C=CC=C(C=1)C(O)=O
[CAS DataBase Reference]

621-18-1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
[HS Code ]

2927.00.5000
Hazard InformationBack Directory
[Uses]

3,3'-AZODIBENZOIC ACID is used as a ligand in the synthesis of MOF materials.
Spectrum DetailBack Directory
[Spectrum Detail]

3,3'-AZODIBENZOIC ACID(621-18-1)MS
3,3'-AZODIBENZOIC ACID(621-18-1)1HNMR
3,3'-AZODIBENZOIC ACID(621-18-1)IR1
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