Basic information
- CAS
5096-19-5- Standard SMILES
CC(=O)Nc1ccc2oc(=O)c3ccccc3c2c1- InChIKey
RCYCXZHAYRTYPO-UHFFFAOYSA-N- Molecular formula
- C15H11NO3
- Average molar mass
- 253.25 g/mol
- Monoisotopic mass
- 253.07389321
Overview
2-Acetamido-6H-dibenzo[b,d]pyran-6-one is a member of coumarins.
Names & identifiers
- Preferred name
- 6H-DIBENZO(b,d)PYRAN-6-ONE, 2-ACETAMIDO-
- IUPAC
- N-(6-oxobenzo[c]chromen-2-yl)acetamide
- English name
- Dibenzo[b,d]pyran-6-one,2-acetamido-
- Molecular formula
- C15H11NO3
- Molecular weight
- 253.25
Names & synonyms
5096-19-56H-DIBENZO(b,d)PYRAN-6-ONE, 2-ACETAMIDO-N-6-(3,4-Benzocoumarinyl)acetamide2D6P941WZJN-(6-Oxo-6H-dibenzo(b,d)pyran-1-yl)acetamideN-(6-Oxo-6H-dibenzo(b,d)pyran-2-yl)acetamideNSC-677212-Acetamido-6H-dibenzo[b,d]pyran-6-oneAcetamide, N-(6-oxo-6H-dibenzo(b,d)pyran-2-yl)-N-(6-oxobenzo[c]chromen-2-yl)acetamideN-(6-Oxo-6H-dibenzo[b,d]pyran-1-yl)acetamideN-(6-Oxo-6H-dibenzo[b,d]pyran-2-yl)acetamide
Show more names
Dibenzo[b,d]pyran-6-one,2-acetamido-2-Acetylamino-6H-dibenzo[b,d]pyran-6-oneAcetamide, N-(6-oxo-6H-dibenzo[b,d]pyran-2-yl)-
NSC 67721BRN 0230597N-(6-oxo-6H-benzo[c]chromen-2-yl)acetamideAcetamide,d]pyran-2-yl)-NCIOpen2_003233UNII-2D6P941WZJ4-18-00-07966 (Beilstein Handbook Reference)CHEMBL65919
Database identifiers
- CAS
5096-19-5- PubChem CID
- 21169
- DTXSID
DTXSID60198972- ChEMBL
CHEMBL65919- ChEBI
CHEBI:34256- UNII
- 2D6P941WZJ
- Nikkaji
- J34.838D
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 382
Physicochemical properties
- Boiling point
- 395.42 °C · 395.42°C (rough estimate)
- Density
- 1.2081 · 1.2081 (rough estimate)
- refractive index
- 1.6231 · 1.6231 (estimate)
- FDA UNII
- 2 D6P941WZJ · 2D6P941WZJ
Chemistry & industry
Additional notes
DefinitionChEBI: 2-Acetamido-6H-dibenzo[b,d]pyran-6-one is a member of coumarins.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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