(2,3-Dimethoxybenzyl)(4-methoxybenzyl)amine
Basic information
- CAS
416888-99-8- Standard SMILES
COc1ccc(CNCc2cccc(OC)c2OC)cc1- InChIKey
BTNQGADLTIKABN-UHFFFAOYSA-N- Molecular formula
- C17H21NO3
- Average molar mass
- 287.35 g/mol
- Monoisotopic mass
- 287.15214353
Names & identifiers
- Preferred name
- (2,3-Dimethoxybenzyl)(4-methoxybenzyl)amine
- IUPAC
- N-[(2,3-dimethoxyphenyl)methyl]-1-(4-methoxyphenyl)methanamine
- English name
- CHEMBRDG-BB 5524129
- Molecular formula
- C17H21NO3
- Molecular weight
- 287.35
Names & synonyms
416888-99-8(2,3-DIMETHOXYBENZYL)(4-METHOXYBENZYL)AMINEN-[(2,3-dimethoxyphenyl)methyl]-1-(4-methoxyphenyl)methanamine[(2,3-dimethoxyphenyl)methyl][(4-methoxyphenyl)methyl]amineOprea1_062077DTXSID00353346STK134752AKOS000233658DB-179075ST45169720AK-968/15361954(2,3-dimethoxyphenyl)-N-(4-methoxybenzyl)methanamine
Show more names
CHEMBRDG-BB 5524129(2,3-dimethoxybenzyl)(4-methoxybenzyl)amine(SALTDATA: HBr)Benzenemethanamine, 2,3-dimethoxy-N-[(4-methoxyphenyl)methyl]-
BRD-K64501336-001-01-81-(2,3-dimethoxyphenyl)-N-(4-methoxybenzyl)methanamineN-(2,3-Dimethoxybenzyl)-1-(4-methoxyphenyl)methanamine1-(2,3-Dimethoxyphenyl)-N-[(4-methoxyphenyl)methyl]methanamine1-(2,3-dimethoxyphenyl)-N-[(4-methoxyphenyl)methyl]methanamine--oxalic acid (1/1)
Database identifiers
- CAS
416888-99-8- PubChem CID
- 738533
- DTXSID
DTXSID00353346
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 39.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 279
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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