Basic information
- CAS
116530-07-5- Standard SMILES
Cc1cccc2ccc([N+](=O)[O-])cc12- InChIKey
YAXWLSIDOXNUDW-UHFFFAOYSA-N- Molecular formula
- C11H9NO2
- Average molar mass
- 187.19 g/mol
- Monoisotopic mass
- 187.06332853
Names & identifiers
- Preferred name
- 1-Methyl-7-nitronaphthalene
- IUPAC
- 1-methyl-7-nitronaphthalene
- English name
- 1-Methyl-7-nitronaphthalene
- Molecular formula
- C11H9NO2
- Molecular weight
- 187.19
Names & synonyms
1-Methyl-7-nitronaphthalene116530-07-5CCRIS 7764P496X2834MUNII-P496X2834MNaphthalene, 1-methyl-7-nitro-DTXSID90151419RefChem:76355DTXCID4073910NAPHTHALENE,1-METHYL-7-NITROSCHEMBL9719317DB-083940
Show more names
NAPHTHALENE, 1-METHYL-7-NITRO
Q27894297
Database identifiers
- CAS
116530-07-5- PubChem CID
- 86323
- DTXSID
DTXSID90151419- UNII
- P496X2834M
- Nikkaji
- J737.760F
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 224
Physicochemical properties
- FDA UNII
- 496 X2834M · P496X2834M
Chemistry & industry
Suppliers1 total
SYNCHEM-OHG[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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