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ChemicalBook--->CAS DataBase List--->1245-13-2

1245-13-2

1245-13-2 Structure

1245-13-2 Structure
IdentificationMore
[Name]

2,2'-BICINCHONINIC ACID
[CAS]

1245-13-2
[Synonyms]

2,2'-BICINCHONINIC ACID
2,2'-BIQUINOLINE-4,4'-DICARBOXYLIC ACID
[2,2']BIQUINOLINYL-4,4'-DICARBOXYLIC ACID
4,4'-DICARBOXY-2,2'-BIQUINOLINE
AKOS AUF0361
BCA
BCA REAGENT A, 250 ML
BICINCHONINIC ACID
BICINCHONINIC ACID,4,4'-DICARBOXY-2,2'-BIQUINOLINE
TIMTEC-BB SBB002943
BICINCHONINIC ACID,(BCA)(TM) SOLID (SODIUM SALT)25 GM
2,2'-Bi[4-quinolinecarboxylic acid]
[EINECS(EC#)]

214-990-9
[Molecular Formula]

C20H12N2O4
[MDL Number]

MFCD00068342
[Molecular Weight]

344.32
[MOL File]

1245-13-2.mol
Chemical PropertiesBack Directory
[Melting point ]

365°C(lit.)
[Boiling point ]

626.2±55.0 °C(Predicted)
[density ]

1.468±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

powder to crystal
[pka]

1.77±0.10(Predicted)
[color ]

Light yellow to Yellow to Orange
[BRN ]

321561
[InChI]

InChI=1S/C20H12N2O4/c23-19(24)13-9-17(21-15-7-3-1-5-11(13)15)18-10-14(20(25)26)12-6-2-4-8-16(12)22-18/h1-10H,(H,23,24)(H,25,26)
[InChIKey]

AFYNADDZULBEJA-UHFFFAOYSA-N
[SMILES]

N1C2C(=CC=CC=2)C(C(O)=O)=CC=1C1C=C(C(O)=O)C2C(N=1)=CC=CC=2
[CAS DataBase Reference]

1245-13-2(CAS DataBase Reference)
[EPA Substance Registry System]

Safety DataBack Directory
[Risk Statements ]

R36:Irritating to the eyes.
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

3
[F ]

8-10
[HS Code ]

29334900
Hazard InformationBack Directory
[Chemical Properties]

Beige powder
[Uses]

2,2′-Biquinoline-4,4′-dicarboxylic acid has been used in a study that synthesized and structurally characterized six metal-organic coordination polymers.
[Purification Methods]

Dissolve the acid in dilute NaOH and precipitate it with acetic acid, filter, wash swell with H2O and dry it at 100o in a vacuum oven. Attempts to form a picrate failed. The methyl ester (SOCl2-MeOH) has m 165.6-166o. [Lesesne & Henze J Am Chem Soc 64 1897 1942, Brown et al. J Am Chem Soc 68 2705 1946, Beilstein 25 III/IV 1148.] For the di-K salt see entry in “Metal-organic Compounds” in Chapter 5.
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

1245-13-2(sigmaaldrich)
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