Home Other Building Blocks 2-(azetidin-3-yl)pyrimidine-4,6-diol dihydrochloride

2-(azetidin-3-yl)pyrimidine-4,6-diol dihydrochloride

CAS No.:
2137852-58-3
Catalog Number:
AG01EJ8H
Molecular Formula:
C7H11Cl2N3O2
Molecular Weight:
240.0871
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Product Description
Catalog Number:
AG01EJ8H
Chemical Name:
2-(azetidin-3-yl)pyrimidine-4,6-diol dihydrochloride
CAS Number:
2137852-58-3
Molecular Formula:
C7H11Cl2N3O2
Molecular Weight:
240.0871
MDL Number:
MFCD31558769
IUPAC Name:
2-(azetidin-3-yl)-4-hydroxy-1H-pyrimidin-6-one;dihydrochloride
InChI:
InChI=1S/C7H9N3O2.2ClH/c11-5-1-6(12)10-7(9-5)4-2-8-3-4;;/h1,4,8H,2-3H2,(H2,9,10,11,12);2*1H
InChI Key:
UJMMOYKQZFSYKN-UHFFFAOYSA-N
SMILES:
Oc1nc(nc(c1)O)C1CNC1.Cl.Cl
Properties
Complexity:
278  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.023g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
240.084g/mol
Monoisotopic Mass:
239.023g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
73.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties