2,3,6,7-Tetrahydrobenzo[1,2-b:4,5-ba(2)]difuran-4-methanamine
Basic information
- CAS
954239-95-3- Standard SMILES
NCc1c2c(cc3c1OCC3)OCC2- InChIKey
HPVIXIFSMVODRH-UHFFFAOYSA-N- Molecular formula
- C11H13NO2
- Average molar mass
- 191.23 g/mol
- Monoisotopic mass
- 191.09462866
Names & identifiers
- Preferred name
- 2,3,6,7-Tetrahydrobenzo[1,2-b:4,5-ba(2)]difuran-4-methanamine
- IUPAC
- 2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-ylmethanamine
Names & synonyms
DTXSID4011940302,3,6,7-Tetrahydrobenzo[1,2-b:4,5-ba(2)]difuran-4-methanamine1-(2,3,6,7-Tetrahydrobenzo[1,2-b:4,5-b']difuran-4-yl)methanamine954239-95-3
Database identifiers
- CAS
954239-95-3- PubChem CID
- 93039166
- DTXSID
DTXSID401194030
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 221
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Compound notes
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