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Basic information
- CAS
21489-51-0- Standard SMILES
CNC1CCc2c(ccc(OC)c2OC)C1- InChIKey
TWLQXTYICBLGEN-UHFFFAOYSA-N- Molecular formula
- C13H19NO2
- Average molar mass
- 221.29 g/mol
- Monoisotopic mass
- 221.14157885
Names & identifiers
- Preferred name
- 5,6-Dimethoxy-N-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
- IUPAC
- 5,6-dimethoxy-N-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
- English name
- 1,2,3,4-Tetrahydro-5,6-dimethoxy-N-methyl-2-naphthalenamine
- Molecular formula
- C13H19NO2
- Molecular weight
- 221.3
Names & synonyms
5,6-dimethoxy-N-methyl-1,2,3,4-tetrahydronaphthalen-2-amine21489-51-0DTXSID70944083RefChem:1072209DTXCID301372437BRN 30936221,2,3,4-Tetrahydro-5,6-dimethoxy-N-methyl-2-naphthylamineSCHEMBL7336826TWLQXTYICBLGEN-UHFFFAOYSA-N5,6-Dimethoxy-N-methyl-1,2,3,4-tetrahydro-beta-naphthalaminebeta-Naphthylamine, 5,6-dimethoxy-N-methyl-1,2,3,4-tetrahydro-2-NAPHTHYLAMINE, 1,2,3,4-TETRAHYDRO-5,6-DIMETHOXY-N-METHYL-
Show more names
1,2,3,4-Tetrahydro-5,6-dimethoxy-N-methyl-2-naphthalenamine2-Naphthalenamine, 1,2,3,4-tetrahydro-5,6-dimethoxy-N-methyl-
5,6-Dimethoxy-2-methylamino-1,2,3,4-tetrahydronaphthalene
Database identifiers
- CAS
21489-51-0- PubChem CID
- 30658
- DTXSID
DTXSID70944083
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 222
Physicochemical properties
- Boiling point
- 346.5 · 346.5±42.0 °C(Predicted)
- Density
- 1.07 · 1.07±0.1 g/cm3(Predicted)
- pka
- 9.96 · 9.96±0.20(Predicted)
Related reactions
5 records
Compound notes
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