Basic information
- Standard SMILES
CC(N)c1cccc2c1OCCO2- InChIKey
LWFUTDAUHWFSRI-UHFFFAOYSA-N- Molecular formula
- C10H13NO2
- Average molar mass
- 179.22 g/mol
Names & identifiers
- Preferred name
- 1-(2,3-Dihydro-benzo[1,4]dioxin-5-yl)-ethylamine
- IUPAC
- 1-(2,3-dihydro-1,4-benzodioxin-5-yl)ethanamine
Names & synonyms
924643-79-81,4-Benzodioxin-5-methanamine, 2,3-dihydro-alpha-methyl-1-(2,3-dihydro-1,4-benzodioxin-5-yl)ethan-1-amineSCHEMBL2401926SCHEMBL22065074LWFUTDAUHWFSRI-UHFFFAOYSA-NEN300-18519211-(2,3-dihydro-benzo[1,4]dioxin-5-yl)-ethylamine1-(2,3-Dihydrobenzo[b][1,4]dioxin-5-yl)ethan-1-amine
Database identifiers
- PubChem CID
- 57725501
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 174
Related reactions
12 records
Linked notes
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