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101803-06-9 | Pyrimidine, 5-iodo-2-methoxy-
CAS No: 101803-06-9 Catalog No: AG0005M6 MDL No:MFCD18412677
Product Description
Catalog Number:
AG0005M6
Chemical Name:
Pyrimidine, 5-iodo-2-methoxy-
CAS Number:
101803-06-9
Molecular Formula:
C5H5IN2O
Molecular Weight:
236.0105
MDL Number:
MFCD18412677
IUPAC Name:
5-iodo-2-methoxypyrimidine
InChI:
InChI=1S/C5H5IN2O/c1-9-5-7-2-4(6)3-8-5/h2-3H,1H3
InChI Key:
HWROBHLYCJFWCE-UHFFFAOYSA-N
SMILES:
COc1ncc(cn1)I
Properties
Complexity:
83
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.945g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.012g/mol
Monoisotopic Mass:
235.945g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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