Basic information
- CAS
15561-61-2- Standard SMILES
CC(C(=O)NCCNC(=O)C(C)N(CCCl)CCCl)N(CCCl)CCCl.Cl.Cl- InChIKey
WNTYFZJHBQBLKA-UHFFFAOYSA-N- Molecular formula
- C16H32Cl6N4O2
- Average molar mass
- 525.2 g/mol
- Monoisotopic mass
- 522.065642
Names & identifiers
- Preferred name
- Propionamide, N,N'-ethylenebis(2-(bis(2-chloroethyl)amino)-, dihydrochloride
- IUPAC
- 2-[bis(2-chloroethyl)amino]-N-[2-[2-[bis(2-chloroethyl)amino]propanoylamino]ethyl]propanamide;dihydrochloride
Names & synonyms
N,N'-Ethylenebis(2-(bis(2-chloroethyl)amino)propionamide) dihydrochloride15561-61-2N,N'-Ethylene-2,2'-bis(bis(2-chloroethyl)amino)bispropionamide dihydrochloridePropionamide, N,N'-ethylenebis(2-(bis(2-chloroethyl)amino)-, dihydrochlorideRefChem:374953DTXSID40935241N,N'-(Ethane-1,2-diyl)bis{2-[bis(2-chloroethyl)amino]propanimidic acid}--hydrogen chloride (1/2)
Database identifiers
- CAS
15561-61-2- PubChem CID
- 203992
- DTXSID
DTXSID40935241
Properties
Computed structural properties
- Topological polar surface area
- 64.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 15
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 356
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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