6-ethynyl-2H-benzo[b][1,4]oxazin-3(4H)-one
Completing data — refresh the page later to see the latest
Basic information
- CAS
627870-58-0- Standard SMILES
C#Cc1ccc2c(c1)NC(=O)CO2- InChIKey
FREJWUFPRNLYFG-UHFFFAOYSA-N- Molecular formula
- C10H7NO2
- Average molar mass
- 173.17 g/mol
Names & identifiers
- Preferred name
- 6-ethynyl-2H-benzo[b][1,4]oxazin-3(4H)-one
- IUPAC
- 6-ethynyl-4H-1,4-benzoxazin-3-one
- English name
- 6-ethynyl-2H-benzo[b][1,4]oxazin-3(4H)-one
- Molecular formula
- C10H7NO2
- Molecular weight
- 173.17
Names & synonyms
6-ethynyl-2H-benzo[b][1,4]oxazin-3(4H)-one627870-58-0SCHEMBL64005822H-1,4-Benzoxazin-3(4H)-one, 6-ethynyl-6-ETHYNYL-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-3-ONE
Database identifiers
- CAS
627870-58-0
Properties
Computed structural propertiesFilling in
- XLogP
- 1.1
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 265
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…