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941294-41-3 | 5-Bromo-4-(4-methoxyphenyl)pyrimidine
CAS No: 941294-41-3 Catalog No: AG003MIS MDL No:MFCD09800946
Product Description
Catalog Number:
AG003MIS
Chemical Name:
5-Bromo-4-(4-methoxyphenyl)pyrimidine
CAS Number:
941294-41-3
Molecular Formula:
C11H9BrN2O
Molecular Weight:
265.1060
MDL Number:
MFCD09800946
IUPAC Name:
5-bromo-4-(4-methoxyphenyl)pyrimidine
InChI:
InChI=1S/C11H9BrN2O/c1-15-9-4-2-8(3-5-9)11-10(12)6-13-7-14-11/h2-7H,1H3
InChI Key:
PMJDLHCYVVWSTG-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1ncncc1Br
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.99g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.11g/mol
Monoisotopic Mass:
263.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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