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85290-76-2

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85290-76-2 Structure

85290-76-2 Structure
IdentificationBack Directory
[Name]

Ethyl 1,3-dimethyl-1H-pyrazole-4-carboxylate
[CAS]

85290-76-2
[Synonyms]

ethyl 1,3-dimethylpyrazole-4-carboxylate
Ethyl 1,3-dimethyl-1H-pyrazole-4-carboxylate
1,3-dimethyl-4-pyrazolecarboxylic acid ethyl ester
1,3-dimethylpyrazole-4-carboxylic acid ethyl ester
1H-Pyrazole-4-carboxylic acid, 1,3-dimethyl-, ethyl ester
[EINECS(EC#)]

604-604-1
[Molecular Formula]

C8H12N2O2
[MDL Number]

MFCD00233458
[MOL File]

85290-76-2.mol
[Molecular Weight]

168.19
Chemical PropertiesBack Directory
[Melting point ]

58-59 °C
[Boiling point ]

85-86 °C(Press: 0.1 Torr)
[density ]

1.12±0.1 g/cm3(Predicted)
[pka]

0.58±0.10(Predicted)
[InChI]

InChI=1S/C8H12N2O2/c1-4-12-8(11)7-5-10(3)9-6(7)2/h5H,4H2,1-3H3
[InChIKey]

UEOAHNKIDQAFPD-UHFFFAOYSA-N
[SMILES]

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

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319-H335-H302+H312+H332-H315
[Precautionary statements ]

P301+P312-P302+P352-P305+P351+P338
[HazardClass ]

IRRITANT
[HS Code ]

2933199090
Spectrum DetailBack Directory
[Spectrum Detail]

Ethyl 1,3-dimethyl-1H-pyrazole-4-carboxylate(85290-76-2)1HNMR
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