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51524-84-6

51524-84-6 Structure

51524-84-6 Structure
IdentificationBack Directory
[Name]

3-METHYLAMINO-BENZOIC ACID
[CAS]

51524-84-6
[Synonyms]

3-METHYLAMINO-BENZOIC ACID
Benzoic acid, 3-(methylamino)-
3-(MethylaMino)benzoic acid HCl
3-(MethylaMino)benzoic acid 97%
Benzoic acid, 3-(methylamino)- (9CI)
3-METHYLAMINO-BENZOIC ACID USP/EP/BP
[Molecular Formula]

C8H9NO2
[MDL Number]

MFCD00894789
[MOL File]

51524-84-6.mol
[Molecular Weight]

151.16
Chemical PropertiesBack Directory
[Melting point ]

122-126 °C
[Boiling point ]

273.17°C (rough estimate)
[density ]

1.2023 (rough estimate)
[refractive index ]

1.5810 (estimate)
[storage temp. ]

2-8°C
[form ]

solid
[pka]

5.10(at 25℃)
[Appearance]

Light yellow to yellow Solid
[Major Application]

peptide synthesis
[InChI]

1S/C8H9NO2/c1-9-7-4-2-3-6(5-7)8(10)11/h2-5,9H,1H3,(H,10,11)
[InChIKey]

ZCCNWBPFIBQFQX-UHFFFAOYSA-N
[SMILES]

CNc1cccc(c1)C(O)=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H319
[Precautionary statements ]

P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

22
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

peptide synthesis
[reaction suitability]

reaction type: solution phase peptide synthesis
[Purification Methods]

Crystallise the acid from H2O (needles), pet ether (plates) or CHCl3 (m 127o). The hydrochloride has m 244o (plates from EtOH). [Beilstein 14 H 391, 14 I 559.]
Spectrum DetailBack Directory
[Spectrum Detail]

3-METHYLAMINO-BENZOIC ACID(51524-84-6)1HNMR
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