ChemicalBook--->CAS DataBase List--->579-93-1

579-93-1

579-93-1 Structure

579-93-1 Structure
IdentificationBack Directory
[Name]

N-BENZOYLANTHRANILICACID
[CAS]

579-93-1
[Synonyms]

DianthraMid B
Dianthramide B
2-(Benzoylamino)
2'-Carboxybenzanilide
2-BenzaMidobenzoic acid
benzoyl anthranilic acid
N-Benzoylanthanilic acid
benzoic acid, 2-(benzoylamino)-
2-(phenylcarbonylamino)benzoic acid
2-[(oxo-phenylmethyl)amino]benzoic acid
[Molecular Formula]

C14H11NO3
[MDL Number]

MFCD00444173
[MOL File]

579-93-1.mol
[Molecular Weight]

241.24
Chemical PropertiesBack Directory
[Melting point ]

178 °C
[Boiling point ]

341.9±25.0 °C(Predicted)
[density ]

1.334±0.06 g/cm3(Predicted)
[FEMA ]

4078 | N-BENZOYLANTHRANILIC ACID
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

3.48±0.36(Predicted)
[Appearance]

White to off-white Solid
[Odor]

fruity
[Odor Type]

fruity
[JECFA Number]

1552
[Major Application]

flavors and fragrances
[InChI]

1S/C14H11NO3/c16-13(10-6-2-1-3-7-10)15-12-9-5-4-8-11(12)14(17)18/h1-9H,(H,15,16)(H,17,18)
[InChIKey]

WXVLIIDDWFGYCV-UHFFFAOYSA-N
[SMILES]

N(c2c(cccc2)C(=O)O)C(=O)c1ccccc1
[LogP]

3.42
Safety DataBack Directory
[WGK Germany ]

WGK 2
[HazardClass ]

IRRITANT
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
Skin Sens. 1
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

White solid, fruity aroma.
[Uses]

flavors and fragrances
[Definition]

ChEBI: An amidobenzoic acid comprising benzoic acid having a benzamido group at the 2-position.
[Aroma threshold values]

Medium strength odor, fruity type.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 54, p. 3744, 1989 DOI: 10.1021/jo00276a045
Spectrum DetailBack Directory
[Spectrum Detail]

N-BENZOYLANTHRANILICACID(579-93-1)1HNMR
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