Basic information
- CAS
10533-87-6- Standard SMILES
CN(C)CCNc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl- InChIKey
FKYJQIBKEDKYFD-UHFFFAOYSA-N- Molecular formula
- C10H11Cl5N2
- Average molar mass
- 336.5 g/mol
- Monoisotopic mass
- 333.936487
Names & identifiers
- Preferred name
- N~1~,N~1~-Dimethyl-N~2~-(pentachlorophenyl)ethane-1,2-diamine
- IUPAC
- N',N'-dimethyl-N-(2,3,4,5,6-pentachlorophenyl)ethane-1,2-diamine
Names & synonyms
10533-87-6NSC66798DTXSID20909445N~1~,N~1~-Dimethyl-N~2~-(pentachlorophenyl)ethane-1,2-diamineNSC-66798
Database identifiers
- CAS
10533-87-6- PubChem CID
- 248985
- DTXSID
DTXSID20909445
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 225
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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