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Basic information
- CAS
956437-89-1- Standard SMILES
COC(=O)CCc1c(C)nn(-c2ccc(C(=O)O)cc2)c1C- InChIKey
DPACGCBBUBERRP-UHFFFAOYSA-N- Molecular formula
- C16H18N2O4
- Average molar mass
- 302.33 g/mol
Names & identifiers
- Preferred name
- 4-[4-(3-METHOXY-3-OXOPROPYL)-3,5-DIMETHYL-1H-PYRAZOL-1-YL]BENZOIC ACID
- English name
- 4-[4-(3-METHOXY-3-OXOPROPYL)-3,5-DIMETHYL-1H-PYRAZOL-1-YL]BENZOIC ACID
- Molecular formula
- C16H18N2O4
- Molecular weight
- 302.33
Names & synonyms
4-Methyl 1-(4-carboxy-phenyl)-3,5-dimethyl-1H-pyrazol-4-propanoate4-Methyl 1-(4-carboxyphenyl)-3,5-dimethyl-1H-pyrazole-4-propanoate4-[4-(3-methoxy-3-oxopropyl)-3,5-dimethylpyrazol-1-yl]benzoic acid4-[4-(3-METHOXY-3-OXOPROPYL)-3,5-DIMETHYL-1H-PYRAZOL-1-YL]BENZOIC ACID1H-Pyrazole-4-propanoic acid, 1-(4-carboxyphenyl)-3,5-dimethyl-, 4-methyl ester
Database identifiers
- CAS
956437-89-1- PubChem CID
- 4962425
- EC Number
- 887-229-7
Properties
Physicochemical properties
- Boiling point
- 468.2 · 468.2±45.0 °C(Predicted)
- Density
- 1.23 · 1.23±0.1 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- 3.83 · 3.83±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
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
- H302-H315-H335-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers3 total
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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