Basic information
- CAS
1521197-87-4- Standard SMILES
CCCNC1COc2cc(OCCCF)ccc21- InChIKey
JIJCQAFTQGEWDB-UHFFFAOYSA-N- Molecular formula
- C14H20FNO2
- Average molar mass
- 253.31 g/mol
- Monoisotopic mass
- 253.14780704
Names & identifiers
- Preferred name
- 3-Benzofuranamine, 6-(3-fluoropropoxy)-2,3-dihydro-N-propyl-
- IUPAC
- 6-(3-fluoropropoxy)-N-propyl-2,3-dihydro-1-benzofuran-3-amine
Names & synonyms
DTXSID201185336AKOS0196763843-Benzofuranamine, 6-(3-fluoropropoxy)-2,3-dihydro-N-propyl-6-(3-Fluoropropoxy)-N-propyl-2,3-dihydro-1-benzofuran-3-amine1521197-87-4
Database identifiers
- CAS
1521197-87-4- PubChem CID
- 81106901
- DTXSID
DTXSID201185336
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 240
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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