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ChemicalBook--->CAS DataBase List--->3222-47-7

3222-47-7

3222-47-7 Structure

3222-47-7 Structure
IdentificationMore
[Name]

6-Methylpyridine-3-carboxylic acid
[CAS]

3222-47-7
[Synonyms]

6-METHYLNICOTINIC ACID
6-METHYLPYRIDINE-3-CARBOXYLIC ACID
RARECHEM AL BO 0418
TIMTEC-BB SBB006666
6-Methylnicotinicacid,99%
6-Methylnicotinic
6-METHYL-3-PYRIDINECARBOXYLIC ACID /
6-METHYLNICOTINIC ACID 98.5+%
6-METHYLINDAN-1-ONE
6-Methylnicotinic acid, 6-Methylpyridine-3-carboxylic acid
[EINECS(EC#)]

670-942-0
[Molecular Formula]

C7H7NO2
[MDL Number]

MFCD00006341
[Molecular Weight]

137.14
[MOL File]

3222-47-7.mol
Chemical PropertiesBack Directory
[Appearance]

White crystalline .
[Melting point ]

210-213 °C (lit.)
[Boiling point ]

251.96°C (rough estimate)
[density ]

1.2528 (rough estimate)
[refractive index ]

1.5030 (estimate)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Powder, Crystals and/or Chunks
[pka]

2.37±0.10(Predicted)
[color ]

White to light yellow to beige
[Water Solubility ]

Sparingly soluble in water.
[BRN ]

112049
[InChI]

InChI=1S/C7H7NO2/c1-5-2-3-6(4-8-5)7(9)10/h2-4H,1H3,(H,9,10)
[InChIKey]

RZOKQIPOABEQAM-UHFFFAOYSA-N
[SMILES]

C1=NC(C)=CC=C1C(O)=O
[CAS DataBase Reference]

3222-47-7(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[HazardClass ]

IRRITANT
[HS Code ]

29333990
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

3-AMINO-6-PYRIDINEMETHANOL-->5-ISOCYANATO-2-METHYL-PYRIDINE-->6-Methoxynicotinic acid-->RARECHEM AL BW 0442-->ETHYL 6-METHYLPYRIDINE-3-CARBOXYLATE
Hazard InformationBack Directory
[Chemical Properties]

White crystalline .
[Uses]

6-Methylnicotinic acid(3222-47-7) is an intermediate of the drug etoricoxib (a non- steroidal anti-inflammatory drug for the treatment of arthritis and osteoarthritis). It is also used as organic intermediates.
[Uses]

A degradation product of Nicotinic acid (N429250). An impurity of Nicotinic acid.
[General Description]

The co-ordination complex of the formula [Ni(L1)2(H2O)4].4H2O where L1H = 6-methylpyridine-3-carboxylic acid(3222-47-7) was structurally charaterized using X-ray single crystal analysis.
Spectrum DetailBack Directory
[Spectrum Detail]

6-Methylpyridine-3-carboxylic acid(3222-47-7)MS
6-Methylpyridine-3-carboxylic acid(3222-47-7)1HNMR
6-Methylpyridine-3-carboxylic acid(3222-47-7)IR1
6-Methylpyridine-3-carboxylic acid(3222-47-7)IR2
6-Methylpyridine-3-carboxylic acid(3222-47-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

6-Methylnicotinic acid, 99%(3222-47-7)
[Alfa Aesar]

6-Methylnicotinic acid, 99%(3222-47-7)
[Sigma Aldrich]

3222-47-7(sigmaaldrich)
[TCI AMERICA]

6-Methylnicotinic Acid,>98.0%(GC)(T)(3222-47-7)
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