Basic information
- CAS
5348-26-5- Standard SMILES
O=[N+]([O-])c1cccc(C=Nc2ccccc2O)c1- InChIKey
DMQAKUSKPGNNGO-UHFFFAOYSA-N- Molecular formula
- C13H10N2O3
- Average molar mass
- 242.23 g/mol
- Monoisotopic mass
- 242.06914219
Overview
See also: 2-(3-Nitrobenzylideneamino)phenol (annotation moved to).
Names & identifiers
- Preferred name
- 2-(((3-Nitrophenyl)methylene)amino)phenol
- IUPAC
- 2-[(3-nitrophenyl)methylideneamino]phenol
- English name
- AI3-51257
- Molecular formula
- C13H10N2O3
- Molecular weight
- 242.23
Names & synonyms
2-[[(3-Nitrophenyl)methylene]amino]phenol2-(((3-Nitrophenyl)methylene)amino)phenolRefChem:4468242-(m-Nitrobenzylideneamino)phenol5348-26-5Phenol, o-((m-nitrobenzylidene)amino)-AI3-51257Phenol, 2-(((3-nitrophenyl)methylene)amino)-NSC-1560Phenol, 2-[[(3-nitrophenyl)methylene]amino]-2-[(3-nitrophenyl)methylideneamino]phenolNSC 1560
Show more names
2-(3-NITROBENZYLIDENEAMINO)PHENOL2-[(m-Nitrobenzylidene)amino]phenol
NSC15605PA2EJ8SDG2-{[(3-NITROPHENYL)METHYLIDENE]AMINO}PHENOLSCHEMBL10118539SCHEMBL15312914DTXSID301271435AKOS003616111N-(3-nitrobenzylidene)-2-hydroxyaniline
Database identifiers
- CAS
5348-26-5- PubChem CID
- 94755
- DTXSID
DTXSID301271435- UNII
- 5PA2EJ8SDG
- Nikkaji
- J50.163H
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 314
Physicochemical properties
- Melting point
- 135 °C · 135 °C
- Boiling point
- 448.6 · 448.6±30.0 °C(Predicted)
- Density
- 1.25 · 1.25±0.1 g/cm3(Predicted)
- pka
- 9.27 · 9.27±0.30(Predicted)
- FDA UNII
- 5 PA2EJ8SDG · 5PA2EJ8SDG
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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
- H315-H335-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
HONEST JOY HOLDINGS LIMITED[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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