Basic information
- CAS
38915-54-7- Standard SMILES
Cl.Cl.ClCCN(CCCl)CCNc1c2ccccc2nc2c1ccc1ccccc12- InChIKey
ZEPZFFRYVDVEPD-UHFFFAOYSA-N- Molecular formula
- C23H25Cl4N3
- Average molar mass
- 485.3 g/mol
- Monoisotopic mass
- 483.080259
Names & identifiers
- Preferred name
- 1,2-Ethanediamine, N'-benz(c)acridin-7-yl-N,N-bis(2-chloroethyl)-, dihydrochloride, hydrate
- IUPAC
- N-benzo[c]acridin-7-yl-N',N'-bis(2-chloroethyl)ethane-1,2-diamine;dihydrochloride
Names & synonyms
ICR 2991,2-Ethanediamine, N'-benz(c)acridin-7-yl-N,N-bis(2-chloroethyl)-, dihydrochloride, hydrate38915-54-7DTXSID301921847-((2-(Bis(2-chloroethyl)amino)ethyl)amino)benz(c)acridine dihydrochloride hydrateBenz(c)acridine, 7-((2-(bis(2-chloroethyl)amino)ethyl)amino)-, dihydrochloride, hydrateRefChem:216220DTXCID40114675N~2~-(Benzo[c]acridin-7-yl)-N~1~,N~1~-bis(2-chloroethyl)ethane-1,2-diamine--hydrogen chloride (1/2)
Database identifiers
- CAS
38915-54-7- PubChem CID
- 217501
- DTXSID
DTXSID30192184
Properties
Computed structural properties
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 471
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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