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1261235-88-4 | Pyrimidine, 5-fluoro-2-(2-pyrrolidinylmethoxy)-, hydrochloride (1:1)
CAS No: 1261235-88-4 Catalog No: AG000RPE MDL No:
Product Description
Catalog Number:
AG000RPE
Chemical Name:
Pyrimidine, 5-fluoro-2-(2-pyrrolidinylmethoxy)-, hydrochloride (1:1)
CAS Number:
1261235-88-4
Molecular Formula:
C9H13ClFN3O
Molecular Weight:
233.6704
IUPAC Name:
5-fluoro-2-(pyrrolidin-2-ylmethoxy)pyrimidine;hydrochloride
InChI:
InChI=1S/C9H12FN3O.ClH/c10-7-4-12-9(13-5-7)14-6-8-2-1-3-11-8;/h4-5,8,11H,1-3,6H2;1H
InChI Key:
RPOSIQIZCOYHML-UHFFFAOYSA-N
SMILES:
Fc1cnc(nc1)OCC1CCCN1.Cl
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.073g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
233.671g/mol
Monoisotopic Mass:
233.073g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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