5,7-Dimethylnaphthalen-1-amine
Basic information
- CAS
147034-11-5- Standard SMILES
Cc1cc(C)c2cccc(N)c2c1- InChIKey
NDDYXDGQJRAXHP-UHFFFAOYSA-N- Molecular formula
- C12H13N
- Average molar mass
- 171.24 g/mol
Names & identifiers
- Preferred name
- 5,7-Dimethylnaphthalen-1-amine
- IUPAC
- 5,7-dimethylnaphthalen-1-amine
- English name
- 1-Naphthalenamine,5,7-dimethyl-(9CI)
- Molecular formula
- C12H13N
- Molecular weight
- 171.24
Names & synonyms
5,7-dimethylnaphthalen-1-amine147034-11-51-Naphthalenamine,5,7-dimethyl-(9CI)1-Naphthalenamine, 5,7-dimethyl-DB-280006
Database identifiers
- CAS
147034-11-5- Nikkaji
- J3.256.806H
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- Boiling point
- 332.9 · 332.9±11.0 °C(Predicted)
- Density
- 1.081 · 1.081±0.06 g/cm3(Predicted)
- pka
- 4.45 · 4.45±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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