Basic information
- CAS
119511-78-3- Standard SMILES
CCOC(=O)C1(N)CCCc2ccccc21- InChIKey
CBMMHKTVGSBBKK-UHFFFAOYSA-N- Molecular formula
- C13H17NO2
- Average molar mass
- 219.28 g/mol
- Monoisotopic mass
- 219.12592879
Names & identifiers
- Preferred name
- Ethyl 1-amino-1,2,3,4-tetrahydro-1-naphthalenecarboxylate
- IUPAC
- ethyl 1-amino-3,4-dihydro-2H-naphthalene-1-carboxylate
Names & synonyms
Ethyl 1-amino-1,2,3,4-tetrahydro-1-naphthalenecarboxylateDTXSID701195425119511-78-3Ethyl 1-amino-1,2,3,4-tetrahydronaphthalene-1-carboxylate
Database identifiers
- CAS
119511-78-3- PubChem CID
- 5145689
- DTXSID
DTXSID701195425
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 267
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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