Basic information
- CAS
7155-17-1- Standard SMILES
O=C(c1ccccc1)N1C(=O)c2ccccc21- InChIKey
VVPBEWFSPBASBT-UHFFFAOYSA-N- Molecular formula
- C14H9NO2
- Average molar mass
- 223.23 g/mol
- Monoisotopic mass
- 223.06332853
Names & identifiers
- Preferred name
- 7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one
- IUPAC
- 7-benzoyl-7-azabicyclo[4.2.0]octa-1,3,5-trien-8-one
- English name
- 7-Benzoyl-7-azabicyclo[4.2.0]octa-1,3,5-trien-8-one
- Molecular weight
- 0
Names & synonyms
7-Benzoyl-7-azabicyclo(4.2.0)octa-1,3,5-trien-8-one7155-17-1UL654IDZ9X7-Benzoyl-7-azabicyclo[4.2.0]octa-1,3,5-trien-8-oneNSC53854NSC 53854UNII-UL654IDZ9XNSC-53854DTXSID20221795VVPBEWFSPBASBT-UHFFFAOYSA-N7-Benzoyl-7-azabicyclo[4.2.0]octa-1,3,5-trien-8-one #7-benzoyl-7-azabicyclo[4.2.0]octa-1(6),2,4-trien-8-one
Show more names
7-AZABICYCLO(4.2.0)OCTA-1,3,5-TRIEN-8-ONE, 7-BENZOYL-
Database identifiers
- CAS
7155-17-1- PubChem CID
- 243716
- DTXSID
DTXSID20221795- UNII
- UL654IDZ9X
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 333
Physicochemical properties
- FDA UNII
- 654 IDZ9X · UL654IDZ9X
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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