Basic information
- CAS
64398-59-0- Standard SMILES
c1ccc(-c2nc(N3CC3)cc(N3CC3)n2)cc1- InChIKey
ULWGUIJKWDAOBW-UHFFFAOYSA-N- Molecular formula
- C14H14N4
- Average molar mass
- 238.29 g/mol
- Monoisotopic mass
- 238.12184646
Names & identifiers
- Preferred name
- Pyrimidine, 4,6-bis(1-aziridinyl)-2-phenyl-
- IUPAC
- 4,6-bis(aziridin-1-yl)-2-phenylpyrimidine
Names & synonyms
Pyrimidine, 4,6-bis(1-aziridinyl)-2-phenyl-64398-59-0BRN 02526594,6-Bis(1-aziridinyl)-2-phenylpyrimidine4,6-Bis-ethyleneimino-2-phenylpyrimidine4,6-bis(aziridin-1-yl)-2-phenylpyrimidine4-25-00-03000 (Beilstein Handbook Reference)DTXSID40214624
Database identifiers
- CAS
64398-59-0- PubChem CID
- 149059
- DTXSID
DTXSID40214624- Nikkaji
- J70.306K
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 31.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 274
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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