Cyclopropyl(3-nitrophenyl)methanone
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Basic information
- CAS
5680-51-3- Standard SMILES
O=C(c1cccc([N+](=O)[O-])c1)C1CC1- InChIKey
SPBSPZKRZGRRSE-UHFFFAOYSA-N- Molecular formula
- C10H9NO3
- Average molar mass
- 191.18 g/mol
- Monoisotopic mass
- 191.05824315
Names & identifiers
- Preferred name
- Cyclopropyl(3-nitrophenyl)methanone
- IUPAC
- cyclopropyl-(3-nitrophenyl)methanone
- English name
- CYCLOPROPYL-(3-NITRO-PHENYL)-METHANONE
- Molecular formula
- C10H9NO3
- Molecular weight
- 191.18
Names & synonyms
Cyclopropyl(3-nitrophenyl)methanone5680-51-3CYCLOPROPYL-(3-NITRO-PHENYL)-METHANONEcyclopropyl-(3-nitrophenyl)methanoneMFCD04114344NSC168880SCHEMBL6175481SCHEMBL29433469DTXSID40305041SPBSPZKRZGRRSE-UHFFFAOYSA-Ncyclopropyl meta-nitrophenyl ketoneAKOS006294161
Show more names
Methanone, cyclopropyl(3-nitrophenyl)-
AB18097NSC-168880AS-63745SY123296DB-072193F319051A1-57917F2167-9489
Database identifiers
- CAS
5680-51-3- PubChem CID
- 297630
- DTXSID
DTXSID40305041
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 255
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
4 records
Compound notes
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