Benzene, 1-nitro-3-phenoxy-
Basic information
- CAS
620-55-3- Standard SMILES
O=[N+]([O-])c1cccc(Oc2ccccc2)c1- InChIKey
MEYCCIQOLYYNLD-UHFFFAOYSA-N- Molecular formula
- C12H9NO3
- Average molar mass
- 215.2 g/mol
- Monoisotopic mass
- 215.05824315
Names & identifiers
- Preferred name
- Benzene, 1-nitro-3-phenoxy-
- IUPAC
- 1-nitro-3-phenoxybenzene
- English name
- 1-nitro-3-phenoxybenzene
- Molecular formula
- C12H9NO3
- Molecular weight
- 215.2
Names & synonyms
1-Nitro-3-phenoxybenzene620-55-3m-Nitrophenyl phenyl ether3-Nitrodiphenyl etherBenzene, 1-nitro-3-phenoxy-Ether, m-nitrophenyl phenyl8UEM35WFJ4EINECS 210-642-5NSC 35133NSC-35133AI3-02921DTXSID6060719
Show more names
Phenyl 3-nitrophenyl ether
RefChem:562527DTXCID1043205210-642-5m-Nitrodiphenyl etherMFCD00767182Benzene,1-nitro-3-phenoxy-3-nitrophenyl phenyl etherp-nitro diphenylether
Database identifiers
- CAS
620-55-3- PubChem CID
- 69284
- DTXSID
DTXSID6060719- UNII
- 8UEM35WFJ4
- EC Number
- 210-642-5
- Nikkaji
- J31.995C
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 233
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Boiling point
- 140 °C · 140 °C(Press: 2.5 Torr)
- Density
- 1.252 · 1.252±0.06 g/cm3(Predicted)
- FDA UNII
- 8 UEM35WFJ4 · 8UEM35WFJ4
- EPA Substance Registry System
- m-Nitrophenyl phenyl ether (620-55-3)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, 1-nitro-3-phenoxy-: INACTIVE
Upstream & downstream products
Downstream products
Suppliers
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Related reactions
5 records
Compound notes
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