Basic information
- CAS
3284-77-3- Standard SMILES
O=[N+]([O-])c1ccccc1C(Cl)Cl- InChIKey
IREGSVSQCKFDNG-UHFFFAOYSA-N- Molecular formula
- C7H5Cl2NO2
- Average molar mass
- 206.02 g/mol
- Monoisotopic mass
- 204.9697338
Names & identifiers
- Preferred name
- 1-(Dichloromethyl)-2-nitrobenzene
- IUPAC
- 1-(dichloromethyl)-2-nitrobenzene
- English name
- 1-(dichloromethyl)-2-nitrobenzene
- Molecular formula
- C7H5Cl2NO2
- Molecular weight
- 206.03
Names & synonyms
1-(Dichloromethyl)-2-nitrobenzene3284-77-3EINECS 221-931-0DTXSID70186507RefChem:74671DTXCID40108998221-931-02-Nitro-benzalchloridSCHEMBL7616610SCHEMBL31207336IREGSVSQCKFDNG-UHFFFAOYSA-N5R55Z4Y8N2
Show more names
o-Nitrobenzylidene chlorideα,α-Dichloro-o-nitrotolueneo-Nitrobenzylidene dichloride
1-(dichloro-methyl)-2-nitro-benzeneBenzene, 1-(dichloromethyl)-2-nitro-SY330729NS00029362
Database identifiers
- CAS
3284-77-3- PubChem CID
- 76779
- DTXSID
DTXSID70186507- UNII
- 5R55Z4Y8N2
- EC Number
- 221-931-0
- Nikkaji
- J7.711I
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 169
Physicochemical properties
- Melting point
- 27 · 27-27.5 °C(Solv: ethanol (64-17-5))
- Boiling point
- 143 · 143-144 °C(Press: 12 Torr)
- Density
- 1.46 · 1.460±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers2 total
深圳市创鑫生物科技有限公司13417589054 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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