Basic information
- CAS
64831-81-8- Standard SMILES
COc1ccc(OC)c2c1C[C@@H](O)[C@H](NCCO)C2.Cl- InChIKey
OCWNILOKYDOIAN-MNMPKAIFSA-N- Molecular formula
- C14H22ClNO4
- Average molar mass
- 303.78 g/mol
- Monoisotopic mass
- 303.1237359
Names & identifiers
- Preferred name
- (2R,3R)-3-(2-hydroxyethylamino)-5,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-ol;hydrochloride
- IUPAC
- (2R,3R)-3-(2-hydroxyethylamino)-5,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-ol;hydrochloride
Names & synonyms
64831-81-8DTXSID60983426(2R,3R)-3-[(2-Hydroxyethyl)amino]-5,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-ol--hydrogen chloride (1/1)2-Naphthalenol, 1,2,3,4-tetrahydro-3-((2-hydroxymethyl)amino)-5,8-dimethoxy-, hydrochloride, trans-3-[(2-Hydroxyethyl)amino]-5,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
64831-81-8- PubChem CID
- 182452
- DTXSID
DTXSID60983426
Properties
Computed structural properties
- Topological polar surface area
- 71 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 276
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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