ChemicalBook--->CAS DataBase List--->31728-75-3

31728-75-3

31728-75-3 Structure

31728-75-3 Structure
IdentificationBack Directory
[Name]

1,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
[CAS]

31728-75-3
[Synonyms]

1,5-Dimethylpyrazole-4-carboxylic acid
1,5-dimethyl-4-pyrazolecarboxylic acid
1H-Pyrazole-4-carboxylicacid,1,5-diMethyl-
1,5-dimethyl-1H-pyrazole-4-carboxylic acid(SALTDATA: FREE)
[Molecular Formula]

C6H8N2O2
[MDL Number]

MFCD02090876
[MOL File]

31728-75-3.mol
[Molecular Weight]

140.14
Chemical PropertiesBack Directory
[Melting point ]

181-183°C
[Boiling point ]

299.2±20.0 °C(Predicted)
[density ]

1.28±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

solid
[pka]

3.51±0.25(Predicted)
[color ]

Off-white
[Water Solubility ]

Slightly soluble in water.
[InChI]

InChI=1S/C6H8N2O2/c1-4-5(6(9)10)3-7-8(4)2/h3H,1-2H3,(H,9,10)
[InChIKey]

SKTIXLZNJZTGRT-UHFFFAOYSA-N
[SMILES]

N1(C)C(C)=C(C(O)=O)C=N1
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P264-P270-P301+P312-P302+P352-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

22-36/37/38
[Safety Statements ]

26
[WGK Germany ]

3
[HS Code ]

2933199090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Questions And AnswerBack Directory
[Application]

1,5-Dimethyl-1H-pyrazole-4-carboxylic acid is a carboxylic acid derivative that can be used as an intermediate in organic synthesis.
Spectrum DetailBack Directory
[Spectrum Detail]

1,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID(31728-75-3)1HNMR
1,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID(31728-75-3)1HNMR
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