Basic information
- CAS
72667-34-6- Standard SMILES
COc1ccc2nc3cc(Cl)ccc3c(NCCNCCCl)c2c1- InChIKey
YMOLIXPQCNADND-UHFFFAOYSA-N- Molecular formula
- C18H19Cl2N3O
- Average molar mass
- 364.3 g/mol
- Monoisotopic mass
- 363.0905176
Names & identifiers
- Preferred name
- 1,2-Ethanediamine, N-(6-chloro-2-methoxy-9-acridinyl)-N'-(2-chloroethyl)-
- IUPAC
- N-(2-chloroethyl)-N'-(6-chloro-2-methoxyacridin-9-yl)ethane-1,2-diamine
Names & synonyms
72667-34-61,2-Ethanediamine, N-(6-chloro-2-methoxy-9-acridinyl)-N'-(2-chloroethyl)-BRN 0442018NS8MSM5N6LN'-(2-chloroethyl)-N-(6-chloro-2-methoxyacridin-9-yl)ethane-1,2-diamineN-(6-Chloro-2-methoxy-9-acridinyl)-N'-(2-chloroethyl)-1,2-ethanediamineDTXSID80222980N-(2-chloroethyl)-N'-(6-chloro-2-methoxyacridin-9-yl)ethane-1,2-diamineN1-(2-Chloroethyl)-N2-(6-chloro-2-methoxy-9-acridinyl)-1,2-ethanediamine1,2-Ethanediamine, N-(2-chloroethyl)-N'-(6-chloro-2-methoxy-9-acridinyl)-1,2-Ethanediamine, N1-(2-chloroethyl)-N2-(6-chloro-2-methoxy-9-acridinyl)-N~1~-(2-Chloroethyl)-N~2~-(6-chloro-2-methoxyacridin-9-yl)ethane-1,2-diamine
Database identifiers
- CAS
72667-34-6- PubChem CID
- 24897
- DTXSID
DTXSID80222980- UNII
- NS8MSM5N6L
- Nikkaji
- J71.398H
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 387
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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