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Home > Bromides > 1199773-23-3
1199773-23-3 | Pyrimidine, 5-bromo-2-(propylthio)-
CAS No: 1199773-23-3 Catalog No: AG000PXJ MDL No:MFCD13195791
Product Description
Catalog Number:
AG000PXJ
Chemical Name:
Pyrimidine, 5-bromo-2-(propylthio)-
CAS Number:
1199773-23-3
Molecular Formula:
C7H9BrN2S
Molecular Weight:
233.1288
MDL Number:
MFCD13195791
IUPAC Name:
5-bromo-2-propylsulfanylpyrimidine
InChI:
InChI=1S/C7H9BrN2S/c1-2-3-11-7-9-4-6(8)5-10-7/h4-5H,2-3H2,1H3
InChI Key:
REVQSUAMCUMXGQ-UHFFFAOYSA-N
SMILES:
CCCSc1ncc(cn1)Br
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.967g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.127g/mol
Monoisotopic Mass:
231.967g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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