2,6-Dichloro-4-nitroaniline--1,2,3,4,5-pentachloro-6-nitrobenzene (1/1)
Basic information
- CAS
37203-85-3- Standard SMILES
Nc1c(Cl)cc([N+](=O)[O-])cc1Cl.O=[N+]([O-])c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl- InChIKey
NYAZAOQABAWNSW-UHFFFAOYSA-N- Molecular formula
- C12H4Cl7N3O4
- Average molar mass
- 502.3 g/mol
- Monoisotopic mass
- 498.802149
Names & identifiers
- Preferred name
- 2,6-Dichloro-4-nitroaniline--1,2,3,4,5-pentachloro-6-nitrobenzene (1/1)
- IUPAC
- 2,6-dichloro-4-nitroaniline;1,2,3,4,5-pentachloro-6-nitrobenzene
Names & synonyms
37203-85-3SCHEMBL4285722DTXSID502754032,6-Dichloro-4-nitroaniline--1,2,3,4,5-pentachloro-6-nitrobenzene (1/1)
Database identifiers
- CAS
37203-85-3- PubChem CID
- 37713
- DTXSID
DTXSID50275403
Properties
Computed structural properties
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 392
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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