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Home > Bromides > 1805506-81-3
1805506-81-3 | Pyrimidine, 2-bromo-5-iodo-4-methyl-
CAS No: 1805506-81-3 Catalog No: AG00223T MDL No:
Product Description
Catalog Number:
AG00223T
Chemical Name:
Pyrimidine, 2-bromo-5-iodo-4-methyl-
CAS Number:
1805506-81-3
Molecular Formula:
C5H4BrIN2
Molecular Weight:
298.9071
IUPAC Name:
2-bromo-5-iodo-4-methylpyrimidine
InChI:
InChI=1S/C5H4BrIN2/c1-3-4(7)2-8-5(6)9-3/h2H,1H3
InChI Key:
PTVLSTFHDZQZAH-UHFFFAOYSA-N
SMILES:
Brc1ncc(c(n1)C)I
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.86g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.909g/mol
Monoisotopic Mass:
297.86g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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