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Basic information
- CAS
887408-90-4- Standard SMILES
CCn1nc(C)c(CCC(=O)O)c1C- InChIKey
OZEFTAJPBHIZPZ-UHFFFAOYSA-N- Molecular formula
- C10H16N2O2
- Average molar mass
- 196.25 g/mol
- Monoisotopic mass
- 196.12117775
Names & identifiers
- Preferred name
- 3-(1-ethyl-3,5-dimethylpyrazol-4-yl)propanoic acid
- IUPAC
- 3-(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-yl)propanoic acid
- English name
- 3-(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-yl)propanoic acid
- Molecular formula
- C10H16N2O2
- Molecular weight
- 196.25
Names & synonyms
1H-Pyrazole-4-propanoic acid, 1-ethyl-3,5-dimethyl-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)propanoic acid3-(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-yl)propanoic acid
Database identifiers
- CAS
887408-90-4- PubChem CID
- 1084875
- DTXSID
DTXSID501323105- ChEMBL
CHEMBL1903403
Properties
Physicochemical properties
- Boiling point
- 343.4 · 343.4±37.0 °C(Predicted)
- Density
- 1.13 · 1.13±0.1 g/cm3(Predicted)
- pka
- 4.54 · 4.54±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H227
- Precautionary statements
- 501 · P501-P210-P264-P280-P302+P352-P370+P378-P337+P313-P305+P351+P338-P362+P364-P332+P313-P403+P235
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H227
- Precautionary statements
- P501-P210-P264-P280-P302+P352-P370+P378-P337+P313-P305+P351+P338-P362+P364-P332+P313-P403+P235
Chemistry & industry
Suppliers1 total
常州合晶化工有限公司85528066 13775048983 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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