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95847-41-9 | 5-IODO-2-(PIPERAZIN-1-YL)PYRIMIDINE
CAS No: 95847-41-9 Catalog No: AG00H7AZ MDL No:MFCD09910321
Product Description
Catalog Number:
AG00H7AZ
Chemical Name:
5-IODO-2-(PIPERAZIN-1-YL)PYRIMIDINE
CAS Number:
95847-41-9
Molecular Formula:
C8H11IN4
Molecular Weight:
290.1042
MDL Number:
MFCD09910321
IUPAC Name:
5-iodo-2-piperazin-1-ylpyrimidine
InChI:
InChI=1S/C8H11IN4/c9-7-5-11-8(12-6-7)13-3-1-10-2-4-13/h5-6,10H,1-4H2
InChI Key:
DITGPXZBELUIBR-UHFFFAOYSA-N
SMILES:
Ic1cnc(nc1)N1CCNCC1
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.003g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.108g/mol
Monoisotopic Mass:
290.003g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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