Basic information
- Standard SMILES
O=Nc1cccc2ccccc12- InChIKey
HXOPMUIUKYURIC-UHFFFAOYSA-N- Molecular formula
- C10H7NO
- Average molar mass
- 157.17 g/mol
- Monoisotopic mass
- 157.05276384
Overview
1-Nitrosonaphthalene is a member of naphthalenes.
Names & identifiers
- Preferred name
- 1-Nitrosonaphthalene
- IUPAC
- 1-nitrosonaphthalene
- English name
- 1-Nitrosonaphthalene
- Molecular formula
- C10H7NO
- Molecular weight
- 157.17
Names & synonyms
1-Nitrosonaphthalene21711-65-9NAPHTHALENE, 1-NITROSO-0Q60ANP22MBRN 2080154UNII-0Q60ANP22MDTXSID501761034-05-00-01673 (Beilstein Handbook Reference)RefChem:76621DTXCID6098594SCHEMBL2933245SCHEMBL17495570
Show more names
1-naphthylnitrosobenzene
SCHEMBL27570890SCHEMBL31126043CHEBI:34108Q27115815
Database identifiers
- CAS
21711-65-9- PubChem CID
- 30767
- DTXSID
DTXSID50176103- ChEBI
CHEBI:34108- UNII
- 0Q60ANP22M
- Nikkaji
- J34.572E
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 29.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 169
Physicochemical properties
- Melting point
- 98 °C · 98°C (rough estimate)
- Boiling point
- 281.82 °C · 281.82°C (rough estimate)
- Density
- 1.1599 · 1.1599 (rough estimate)
- refractive index
- 1.5 · 1.5000 (estimate)
- FDA UNII
- 0 Q60ANP22M · 0Q60ANP22M
- Toxicity
- 1 mg/plate · mma-sat 1 mg/plate MUREAV 94,315,82
Safety & regulation
Safety data
- Toxicity
- mma-sat 1 mg/plate MUREAV 94,315,82
Chemistry & industry
Additional notes
DefinitionChEBI: 1-Nitrosonaphthalene is a member of naphthalenes.
Related reactions
1 records
Linked notes
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