5-Amino-1-acenaphthenol
Basic information
- CAS
81851-72-1- Standard SMILES
Nc1ccc2c3c(cccc13)C(O)C2- InChIKey
IKIHDTOQZUTOPB-UHFFFAOYSA-N- Molecular formula
- C12H11NO
- Average molar mass
- 185.22 g/mol
- Monoisotopic mass
- 185.08406397
Names & identifiers
- Preferred name
- 5-Amino-1-acenaphthenol
- IUPAC
- 5-amino-1,2-dihydroacenaphthylen-1-ol
Names & synonyms
81851-72-15-Amino-1-acenaphthenol1-Hydroxy-5-aminoacenaphthene1-ACENAPHTHENOL, 5-AMINO-1,2-Dihydro-5-amino-1-acenaphthylenol5-amino-1,2-dihydroacenaphthylen-1-ol1-Acenaphthylenol, 1,2-dihydro-5-amino-DTXSID101002268
Database identifiers
- CAS
81851-72-1- PubChem CID
- 54787
- DTXSID
DTXSID101002268
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 230
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Related reactions
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Compound notes
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