Basic information
- CAS
102236-24-8- Standard SMILES
CCOc1ccc(Cl)cc1[N+](=O)[O-]- InChIKey
SKMDJPLCXWZTCN-UHFFFAOYSA-N- Molecular formula
- C8H8ClNO3
- Average molar mass
- 201.61 g/mol
- Monoisotopic mass
- 201.0192708
Names & identifiers
- Preferred name
- 4-Chloro-1-ethoxy-2-nitrobenzene
- IUPAC
- 4-chloro-1-ethoxy-2-nitrobenzene
- English name
- Benzene, 4-chloro-1-ethoxy-2-nitro-
- Molecular formula
- C8H8ClNO3
- Molecular weight
- 201.61
Names & synonyms
4-chloro-1-ethoxy-2-nitrobenzene102236-24-8Benzene, 4-chloro-1-ethoxy-2-nitro-NSC53238Phenetole, 4-chloro-2-nitroSCHEMBL7745381DTXSID102879014-chloro-1-ethoxy-2-nitro-benzeneMFCD18431751NSC-53238Benzene, 4-chloro-1-ethoxy-2-nitroAKOS024438854
Show more names
PhecetinImpurity13Phenacetin Impurity 13
Database identifiers
- CAS
102236-24-8- PubChem CID
- 243442
- DTXSID
DTXSID10287901
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Melting point
- 62 °C · 62 °C(Solv: ethanol (64-17-5))
- Boiling point
- 293.6 · 293.6±20.0 °C(Predicted)
- Density
- 1.311 · 1.311±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers6 total
济南百隆化学有限公司[email protected] · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
上海尺水药物研究有限公司[email protected] 13564957716 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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