1,1',1''-(1,3,5-Triazinane-1,3,5-triyl)tris(3-bromopropan-1-one)
Basic information
- CAS
65174-72-3- Standard SMILES
O=C(CCBr)N1CN(C(=O)CCBr)CN(C(=O)CCBr)C1- InChIKey
UYNTZRFVDTZUQI-UHFFFAOYSA-N- Molecular formula
- C12H18Br3N3O3
- Average molar mass
- 492 g/mol
- Monoisotopic mass
- 488.88983
Names & identifiers
- Preferred name
- 1,1',1''-(1,3,5-Triazinane-1,3,5-triyl)tris(3-bromopropan-1-one)
- IUPAC
- 1-[3,5-bis(3-bromopropanoyl)-1,3,5-triazinan-1-yl]-3-bromopropan-1-one
Names & synonyms
1,1',1''-(1,3,5-triazinane-1,3,5-triyl)tris(3-bromopropan-1-one)65174-72-3DTXSID80288844RefChem:211784DTXCID60239990NSC57840NSC-57840
Database identifiers
- CAS
65174-72-3- PubChem CID
- 245667
- DTXSID
DTXSID80288844
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 60.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 326
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…