ChemicalBook--->CAS DataBase List--->890092-84-9

890092-84-9

890092-84-9 Structure

890092-84-9 Structure
IdentificationBack Directory
[Name]

3-PYRAZOL-1-YL-BUTYRIC ACID
[CAS]

890092-84-9
[Synonyms]

AKOS PAO-1019
AKOS BBS-00005872
IFLAB-BB F1986-0002
TIMTEC-BB SBB010347
3-PYRAZOL-1-YL-BUTYRIC ACID
3-pyrazol-1-ylbutanoic acid
3-(1-pyrazolyl)butanoic acid
3-(1H-PYRAZOL-1-YL)BUTANOIC ACID
3-(1H-pyrazole-1-yl)butanoic acid
1H-Pyrazole-1-propanoic acid, β-methyl-
3-(1H-pyrazol-1-yl)butanoic acid(SALTDATA: FREE)
[Molecular Formula]

C7H10N2O2
[MDL Number]

MFCD06589818
[MOL File]

890092-84-9.mol
[Molecular Weight]

154.17
Chemical PropertiesBack Directory
[Boiling point ]

301.7±25.0 °C(Predicted)
[density ]

1.22±0.1 g/cm3(Predicted)
[form ]

solid
[pka]

4.25±0.10(Predicted)
[InChI]

1S/C7H10N2O2/c1-6(5-7(10)11)9-4-2-3-8-9/h2-4,6H,5H2,1H3,(H,10,11)
[InChIKey]

LLMHIHGJTUQQRA-UHFFFAOYSA-N
[SMILES]

O=C(O)CC(C)N1N=CC=C1
Safety DataBack Directory
[Hazard Codes ]

Xi
[WGK Germany ]

3
[HazardClass ]

IRRITANT
[Storage Class]

11 - Combustible Solids
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