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3112-31-0

3112-31-0 Structure

3112-31-0 Structure
IdentificationMore
[Name]

3,5-PYRAZOLEDICARBOXYLIC ACID
[CAS]

3112-31-0
[Synonyms]

1H-PYRAZOLE-3,5-DICARBOXYLIC ACID
3,5-PYRAZOLEDICARBOXYLIC ACID
LABOTEST-BB LT00451775
PYRAZOLE-3,5-DICARBOXYLIC ACID
3,5-PYRAZOLEDICARBOXYLIC ACID HYDRATE
3,5-Pyrazoledicarboxylic acid ,98%
[EINECS(EC#)]

221-474-7
[Molecular Formula]

C5H4N2O4
[MDL Number]

MFCD00005235
[Molecular Weight]

156.1
[MOL File]

3112-31-0.mol
Chemical PropertiesBack Directory
[Appearance]

white crystalline powder
[Melting point ]

292-295 °C (dec.)(lit.)
[Boiling point ]

614.4±40.0 °C(Predicted)
[density ]

1.814±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[form ]

Crystalline Powder
[pka]

3.24±0.10(Predicted)
[color ]

White
[Detection Methods]

HPLC
[CAS DataBase Reference]

3112-31-0(CAS DataBase Reference)
Safety DataBack Directory
[Risk Statements ]

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

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[HS Code ]

29331990
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethanol-->Methanol-->Chloroform-->Formaldehyde-->Potassium permanganate-->3,5-Dimethylpyrazole-->3-ethyl-5-methyl-1H-pyrazole-->3,5-(1H)-pyrazoledicarbaldehyde-->ethyl 3-forMyl-4,5-dihydro-1H-pyrazole-5-carboxylate-->5-Methyl-1H-pyrazole-3-carboxylic acid-->5-Pyrazolecarboxylic acid-->2,4-OCTANEDIONE-->CHEMBRDG-BB 4005123-->DIETHYL 3,5-PYRAZOLEDICARBOXYLATE
[Preparation Products]

5-N-Boc-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylic acid-->1,3,5-TRIMETHYL-PYRAZOLE-3,5-DICARBOXYLATE-->3, 5- Bis(benzimidazol-2-yl)pyrazole-->Dimethyl 1H-pyrazole-3,5-dicarboxylate
Hazard InformationBack Directory
[Chemical Properties]

white crystalline powder
[Purification Methods]

It crystallises from water as a monohydrate, or EtOH. Dry it in a vacuum at 100o. The dimethyl ester crystallises from *C6H6 with m 155o. [Beilstein 25 III/IV 1047.]
Spectrum DetailBack Directory
[Spectrum Detail]

3,5-PYRAZOLEDICARBOXYLIC ACID(3112-31-0)MS
3,5-PYRAZOLEDICARBOXYLIC ACID(3112-31-0)1HNMR
3,5-PYRAZOLEDICARBOXYLIC ACID(3112-31-0)13CNMR
3,5-PYRAZOLEDICARBOXYLIC ACID(3112-31-0)IR1
3,5-PYRAZOLEDICARBOXYLIC ACID(3112-31-0)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3,5-Pyrazoledicarboxylic acid monohydrate, 97%(3112-31-0)
[Sigma Aldrich]

3112-31-0(sigmaaldrich)
[TCI AMERICA]

3,5-Pyrazoledicarboxylic Acid  Monohydrate,>98.0%(T)(3112-31-0)
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