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Home > Bromides > 1215206-57-7
1215206-57-7 | Pyrimidine, 5-bromo-2-butoxy-
CAS No: 1215206-57-7 Catalog No: AG00157N MDL No:MFCD15143619
Product Description
Catalog Number:
AG00157N
Chemical Name:
Pyrimidine, 5-bromo-2-butoxy-
CAS Number:
1215206-57-7
Molecular Formula:
C8H11BrN2O
Molecular Weight:
231.0897
MDL Number:
MFCD15143619
IUPAC Name:
5-bromo-2-butoxypyrimidine
InChI:
InChI=1S/C8H11BrN2O/c1-2-3-4-12-8-10-5-7(9)6-11-8/h5-6H,2-4H2,1H3
InChI Key:
QSKVKWALGAQJRQ-UHFFFAOYSA-N
SMILES:
CCCCOc1ncc(cn1)Br
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.005g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.093g/mol
Monoisotopic Mass:
230.005g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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