Basic information
- CAS
6580-77-4- Standard SMILES
O=C(CN1CC1)NCCCCCCCNC(=O)CN1CC1- InChIKey
IDLWIWBLBLQMGT-UHFFFAOYSA-N- Molecular formula
- C15H28N4O2
- Average molar mass
- 296.41 g/mol
- Monoisotopic mass
- 296.22122615
Names & identifiers
- Preferred name
- 1-Aziridineacetamide, N,N'-(heptamethylene)bis-
- IUPAC
- 2-(aziridin-1-yl)-N-[7-[[2-(aziridin-1-yl)acetyl]amino]heptyl]acetamide
Names & synonyms
6580-77-41-AZIRIDINEACETAMIDE, N,N'-(HEPTAMETHYLENE)BIS-N,N'-Bis(aziridineacetyl)-1,7-heptamethylenediamine1-Aziridineacetamide, N,N'-1,7-heptanediylbis-8PE65M0PFCNSC-111719N,N'-1,7-Heptanediylbis(1-aziridineacetamide)NSC 111719N,N'-(Heptamethylene)bis(1-aziridineacetamide)NSC111719UNII-8PE65M0PFCDTXSID30215988
Show more names
1-Aziridineacetamide,N'-heptamethylenebis-1-Aziridineacetamide,N'-1,7-heptanediylbis-1-Aziridineacetamide, N,N'-heptamethylenebis-N,N'-(Heptane-1,7-diyl)bis[2-(aziridin-1-yl)acetamide]N,N'-BIS(AZIRIDINYLACETYL)-1,7-HEPTAMETHYLENEDIAMINE
Database identifiers
- CAS
6580-77-4- PubChem CID
- 23055
- DTXSID
DTXSID30215988- UNII
- 8PE65M0PFC
- Nikkaji
- J84.716J
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 64.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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