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

HCID 159706
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Basic information

CAS
13922-83-3
Standard SMILES
Clc1c(N2CC2)nc(N2CC2)nc1N1CC1
InChIKey
KLGFLRLLTLZESG-UHFFFAOYSA-N
Molecular formula
C10H12ClN5
Average molar mass
237.69 g/mol
Monoisotopic mass
237.0781231

Names & identifiers

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

Names & synonyms

Pyrimidine, 2,4,6-tris(1-aziridinyl)-5-chloro-13922-83-32,4,6-Tris(1-aziridinyl)-5-chloropyrimidineBRN 08118102,4,6-Triethylenimino-5-chloropyrimidine5-Chloro-2,4,6-triethyleniminopyrimidineDTXSID30160969LS-13778DB-2635274,6-Bis(aziridin-1-yl)-2-(aziridin-1-yl)-5-chloropyrimidine

Database identifiers

CAS
13922-83-3
PubChem CID
159706
DTXSID
DTXSID30160969
Nikkaji
J85.933H

Properties

Computed structural properties

XLogP
1.5
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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