Structure Info
- Chemspace ID
- CSMB00000285920 (Enamine MADE)
- CAS
- 1179202-94-8
- MFCD
- MFCD12567712
- IUPAC Name
- ethyl 8-amino-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate
- Mol formula
- C12H15NO4
- Mol weight
- 237 Da
- Catalog Number(s)
- BBV-29348216, CS-0288928, CSC000285920, EN300-6511370, HY-W226428, s_1458_25976442_483918, s_1458____25976442____483918
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.73
- Heavy atoms count
- 17
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.416
- Polar surface area (Å)
- 71
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00000285920
Items Overall 1 item from 1 supplier
For a custom pack size or bulk
please drop us a line:Enquire
please drop us a line:Enquire