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Pyrimidine, 5-bromo-2,4,6-tris(1-aziridinyl)-

HCID 203115
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Basic information

CAS
13922-84-4
Standard SMILES
Brc1c(N2CC2)nc(N2CC2)nc1N1CC1
InChIKey
CUNSZHPJMHWYKA-UHFFFAOYSA-N
Molecular formula
C10H12BrN5
Average molar mass
282.14 g/mol
Monoisotopic mass
281.02761

Names & identifiers

Preferred name
Pyrimidine, 5-bromo-2,4,6-tris(1-aziridinyl)-
IUPAC
2,4,6-tris(aziridin-1-yl)-5-bromopyrimidine

Names & synonyms

BRN 0811811Pyrimidine, 5-bromo-2,4,6-tris(1-aziridinyl)-2,4,6-Tri(ethyleneimino)-5-bromopyrimidine5-Bromo-2,4,6-tris(1-aziridinyl)pyrimidine13922-84-4DTXSID401609705-25-12-00320 (Beilstein Handbook Reference)RefChem:377667DTXCID50834614,6-Bis(aziridin-1-yl)-2-(aziridin-1-yl)-5-bromopyrimidine

Database identifiers

CAS
13922-84-4
PubChem CID
203115
DTXSID
DTXSID40160970

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
34.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
16
Formal charge
0
Complexity
267

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Compound notes

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