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864654-95-5 | 6-Isopropyl-2-(methylthio)pyrimidin-4-ol
CAS No: 864654-95-5 Catalog No: AG01FLMC MDL No:
Product Description
Catalog Number:
AG01FLMC
Chemical Name:
6-Isopropyl-2-(methylthio)pyrimidin-4-ol
CAS Number:
864654-95-5
IUPAC Name:
2-methylsulfanyl-4-propan-2-yl-1H-pyrimidin-6-one
InChI:
InChI=1S/C8H12N2OS/c1-5(2)6-4-7(11)10-8(9-6)12-3/h4-5H,1-3H3,(H,9,10,11)
InChI Key:
WSBGKEVVRHNGOB-UHFFFAOYSA-N
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.067g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
184.257g/mol
Monoisotopic Mass:
184.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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