2-Benzofuranmethylamine, 2,3-dihydro-N,5-dimethyl-, maleate (1:1)
Basic information
- CAS
34336-46-4- Standard SMILES
C[NH2+]CC1Cc2cc(C)ccc2O1.O=C([O-])/C=C\C(=O)O- InChIKey
OJZUOGPFNKSWPX-BTJKTKAUSA-N- Molecular formula
- C15H19NO5
- Average molar mass
- 293.31 g/mol
- Monoisotopic mass
- 293.12632271
Names & identifiers
- Preferred name
- 2-Benzofuranmethylamine, 2,3-dihydro-N,5-dimethyl-, maleate (1:1)
- IUPAC
- (Z)-4-hydroxy-4-oxobut-2-enoate;methyl-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methyl]azanium
Names & synonyms
2-BENZOFURANMETHYLAMINE, 2,3-DIHYDRO-N,5-DIMETHYL-, MALEATE (1:1)34336-46-4RefChem:10623482,3-Dihydro-N,5-dimethyl-2-benzofuranmethylamine maleate
Database identifiers
- CAS
34336-46-4- PubChem CID
- 6434166
Properties
Computed structural properties
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 301
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