Basic information
- CAS
61034-11-5- Standard SMILES
O=c1c(-c2cnn(-c3ccccc3)c2)coc2cc(O)ccc12- InChIKey
SNBGJFLBMNUDEU-UHFFFAOYSA-N- Molecular formula
- C18H12N2O3
- Average molar mass
- 304.3 g/mol
- Monoisotopic mass
- 304.08479225
Names & identifiers
- Preferred name
- 7-Hydroxy-3-(1-phenyl-1H-pyrazol-4-yl)-chromen-4-one
- IUPAC
- 7-hydroxy-3-(1-phenylpyrazol-4-yl)chromen-4-one
- English name
- 7-HYDROXY-3-(1-PHENYL-1H-PYRAZOL-4-YL)-CHROMEN-4-ONE
- Molecular formula
- C18H12N2O3
- Molecular weight
- 304.3
Names & synonyms
61034-11-57-Hydroxy-3-(1-phenyl-1H-pyrazol-4-yl)-chromen-4-oneDTXSID80419914RefChem:310827DTXCID103707617-hydroxy-3-(1-phenyl-1H-pyrazol-4-yl)-4H-chromen-4-one7-hydroxy-3-(1-phenylpyrazol-4-yl)chromen-4-oneMLS000689960SMR0002986817-Hydroxy-3-(1-phenyl-1H-pyrazol-4-yl)-4H-1-benzopyran-4-oneCambridge id 6668770Oprea1_065852
Show more names
4H-1-Benzopyran-4-one, 7-hydroxy-3-(1-phenyl-1H-pyrazol-4-yl)-
Oprea1_102339CHEMBL1345622SCHEMBL29785150BDBM44231cid_5407918HMS2640M19LCA03411AKOS000122679
Database identifiers
- CAS
61034-11-5- PubChem CID
- 5407918
- DTXSID
DTXSID80419914- ChEMBL
CHEMBL1345622- EC Number
- 188-626-1
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 487
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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