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Home > Bromides > 1443792-51-5
1443792-51-5 | Pyrimidine, 5-bromo-2-iodo-4-methoxy-
CAS No: 1443792-51-5 Catalog No: AG001JER MDL No:
Product Description
Catalog Number:
AG001JER
Chemical Name:
Pyrimidine, 5-bromo-2-iodo-4-methoxy-
CAS Number:
1443792-51-5
Molecular Formula:
C5H4BrIN2O
Molecular Weight:
314.9065
IUPAC Name:
5-bromo-2-iodo-4-methoxypyrimidine
InChI:
InChI=1S/C5H4BrIN2O/c1-10-4-3(6)2-8-5(7)9-4/h2H,1H3
InChI Key:
LXVYSZJDZSIXTM-UHFFFAOYSA-N
SMILES:
COc1nc(I)ncc1Br
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.855g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.908g/mol
Monoisotopic Mass:
313.855g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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