Basic information
- CAS
131-65-7- Standard SMILES
CCc1ccccc1N1N=C(C)CC1=O- InChIKey
HKFAMUCGCCUZMC-UHFFFAOYSA-N- Molecular formula
- C12H14N2O
- Average molar mass
- 202.25 g/mol
- Monoisotopic mass
- 202.11061307
Names & identifiers
- Preferred name
- 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one
- IUPAC
- 2-(2-ethylphenyl)-5-methyl-4H-pyrazol-3-one
- English name
- 2,4-dihydro-3-methyl-2-phenethyl-3H-pyrazol-3-one
- Molecular formula
- C12H14N2O
- Molecular weight
- 202.25
Names & synonyms
3H-Pyrazol-3-one, 2-(2-ethylphenyl)-2,4-dihydro-5-methyl-1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-oneEINECS 205-034-1YA9FDN3EYB2,4-Dihydro-3-methyl-2-phenethyl-3H-pyrazol-3-oneDTXSID0059619Pyrazole, 1-(2-ethylphenyl)-4,5-dihydro-3-methyl-1H-3-oxo-1-(2-ETHYLPHENYL)-3-METHYL-2-PYRAZOLIN-5-ONE2-(2-ETHYLPHENYL)-2,4-DIHYDRO-5-METHYL-3H-PYRAZOL-3-ONERefChem:196985DTXCID5034010131-65-7
Show more names
2,3-Dihydro-3-methyl-2-(2-phenylethyl)-1H-pyrazol-3-ol
2-(2-ethylphenyl)-5-methyl-4H-pyrazol-3-one1-(2-Ethylphenyl)-3-methyl-1H-pyrazol-5(4H)-oneCHEMBL3740761UNII-YA9FDN3EYBSCHEMBL105976851-(2-ethylphenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-oneHKFAMUCGCCUZMC-UHFFFAOYSA-NBDBM50135197
Database identifiers
- CAS
131-65-7- PubChem CID
- 67232
- DTXSID
DTXSID0059619- ChEMBL
CHEMBL3740761
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 285
Physicochemical properties
- FDA UNII
- 9 FDN3EYB · YA9FDN3EYB
- EPA Substance Registry System
- 3 H-Pyrazol-3-one, · 3H-Pyrazol-3-one, 2-(2-ethylphenyl)-2,4-dihydro-5-methyl- (131-65-7)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information3H-Pyrazol-3-one, 2-(2-ethylphenyl)-2,4-dihydro-5-methyl-: INACTIVE
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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