Basic information
- CAS
26882-70-2- Standard SMILES
c1cc2c(cc1NC1=NCCO1)OCO2- InChIKey
SMPAXXXLWWFLFY-UHFFFAOYSA-N- Molecular formula
- C10H10N2O3
- Average molar mass
- 206.2 g/mol
- Monoisotopic mass
- 206.06914219
Names & identifiers
- Preferred name
- Aniline, 3,4-methylenedioxy-N-(2-oxazolinyl)-
- IUPAC
- N-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3-oxazol-2-amine
Names & synonyms
ANILINE, 3,4-METHYLENEDIOXY-N-(2-OXAZOLINYL)-BRN 09945462-(3,4-Methylenedioxyaniline)-2-oxazoline26882-70-2DTXSID60181389RefChem:319587DTXCID20103880NSC664285CHEMBL1978933N-(1,3-Benzodioxol-5-yl)-4,5-dihydro-1,3-oxazol-2-amineNSC-664285NCI60_022160
Show more names
N-(1,3-benzodioxol-5-yl)-4,5-dihydrooxazol-2-amineN-(1,3-Benzodioxol-5-yl)-N-(4,5-dihydro-1,3-oxazol-2-yl)amineN-(2H-1,3-BENZODIOXOL-5-YL)-4,5-DIHYDRO-1,3-OXAZOL-2-AMINE
Database identifiers
- CAS
26882-70-2- PubChem CID
- 33632
- DTXSID
DTXSID60181389- ChEMBL
CHEMBL1978933
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 269
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…