Basic information
- CAS
2798-17-6- Standard SMILES
O=C(c1ccc(C(=O)N2CC2)cc1)N1CC1- InChIKey
SGJASIVTRHOIFX-UHFFFAOYSA-N- Molecular formula
- C12H12N2O2
- Average molar mass
- 216.24 g/mol
- Monoisotopic mass
- 216.08987763
Names & identifiers
- Preferred name
- Terephthaloylbis(1-aziridine)
- IUPAC
- [4-(aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone
Names & synonyms
Terephthaloylbis(1-aziridine)2798-17-6Terephthaloylbis(1-ethylenimine)TerephthalylethyeneimineAziridine, 1,1'-terephthaloylbis-Aziridine, 1,1'-(1,4-phenylenedicarbonyl)bis-K7NQ26S6DNAI3-50526NIOSH/CM8870000Aziridine, 1,1'-terephthaloydi-NSC-21595CM88700000
Show more names
[4-(aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanoneNSC 21595UNII-K7NQ26S6DNAziridine,1'-terephthaloylbis-SCHEMBL8747189DTXSID80950675NSC21595DS-006431
Database identifiers
- CAS
2798-17-6- PubChem CID
- 95169
- DTXSID
DTXSID80950675- UNII
- K7NQ26S6DN
- Nikkaji
- J62.406C
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 40.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 281
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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