Basic information
- CAS
83-69-2- Standard SMILES
Cc1cc(O)c2ccccc2c1N- InChIKey
YJRCNAAPGQBVFS-UHFFFAOYSA-N- Molecular formula
- C11H11NO
- Average molar mass
- 173.21 g/mol
- Monoisotopic mass
- 173.08406397
Names & identifiers
- Preferred name
- 4-Amino-3-methyl-1-naphthalenol
- IUPAC
- 4-amino-3-methylnaphthalen-1-ol
- English name
- 4-amino-3-methylnaphthol
- Molecular formula
- C11H11NO
- Molecular weight
- 173.21
Names & synonyms
Vitamin K74-amino-3-methylnaphthalen-1-ol83-69-2HEE4JPA7DF1-amino-2-methyl-4-naphtholDTXSID102321133-METHYL-4-AMINO-1-NAPHTHOL2-METHYL-4-HYDROXY-1-NAPHTHYLAMINE1-HYDROXY-3-METHYL-4-AMINONAPHTHALENERefChem:1070260DTXCID101546044-Amino-3-methyl-1-naphthalenol
Show more names
201-495-84-amino-3-methyl-1-naphthol4-Amino-3-methylnaphtholUNII-HEE4JPA7DFEINECS 201-495-81-Naphthalenol, 4-amino-3-methyl-SCHEMBL353534YJRCNAAPGQBVFS-UHFFFAOYSA-N
Database identifiers
- CAS
83-69-2- PubChem CID
- 66524
- DTXSID
DTXSID10232113- UNII
- HEE4JPA7DF
- EC Number
- 201-495-8
- Nikkaji
- J4.641H
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Boiling point
- 392 · 392.0±30.0 °C(Predicted)
- Density
- 1.232 · 1.232±0.06 g/cm3(Predicted)
- pka
- 9.87 · 9.87±0.40(Predicted)
- FDA UNII
- 4 JPA7DF · HEE4JPA7DF
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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