Ethyl 7-methyl-2-(thiophen-2-yl)pyrazolo[1,5-a]pyrimidine-6-carboxylate
Basic information
- CAS
162286-69-3- Standard SMILES
CCOC(=O)c1cnc2cc(-c3cccs3)nn2c1C- InChIKey
CBRIFKWJWUKPOW-UHFFFAOYSA-N- Molecular formula
- C14H13N3O2S
- Average molar mass
- 287.34 g/mol
- Monoisotopic mass
- 287.07284784
Names & identifiers
- Preferred name
- Ethyl 7-methyl-2-(thiophen-2-yl)pyrazolo[1,5-a]pyrimidine-6-carboxylate
- IUPAC
- ethyl 7-methyl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-6-carboxylate
- English name
- ETHYL 7-METHYL-2-(2-THIENYL)PYRAZOLO[1,5-A]PYRIMIDINE-6-CARBOXYLATE
- Molecular formula
- C14H13N3O2S
- Molecular weight
- 287.34
Names & synonyms
162286-69-3ethyl 7-methyl-2-(thiophen-2-yl)pyrazolo[1,5-a]pyrimidine-6-carboxylateETHYL 7-METHYL-2-(2-THIENYL)PYRAZOLO[1,5-A]PYRIMIDINE-6-CARBOXYLATEethyl 7-methyl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-6-carboxylateMFCD00067907Ethyl 7-methyl-2-(thien-2-yl)pyrazolo[1,5-a]-pyrimidine-6-carboxylateETHYL7-METHYL-2-(2-THIENYL)PYRAZOLO[1,5-A]PYRIMIDINE-6-CARBOXYLATEMaybridge1_004718Oprea1_290977HMS554O10DTXSID30371371AKOS022181673
Show more names
BUTTPARK 94\04-24Pyrazolo[1,5-a]pyrimidine-6-carboxylic acid, 7-methyl-2-(2-thienyl)-, ethyl ester
AS-9116DB-004525CS-0324242Ethyl 7-methyl-2-(2-thienyl)pyrazolo-[1,5-a]pyrimidine-6-carboxylate
Database identifiers
- CAS
162286-69-3- PubChem CID
- 2736452
- DTXSID
DTXSID30371371
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 84.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 368
Physicochemical properties
- Density
- 1.37 · 1.37±0.1 g/cm3(Predicted)
- pka
- -0.53 · -0.53±0.30(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H317
- Precautionary statements
- 305 · P305+P351+P338-P280
- HS Code
- 2933599590 · 2933599590
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
- hs_code
- 2933599590
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H317
- Precautionary statements
- P305+P351+P338-P280
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Related reactions
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Compound notes
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