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1499503-95-5 | Pyrimidine, 4-chloro-6-(methoxymethyl)-2-(methylthio)-
CAS No: 1499503-95-5 Catalog No: AG001M5N MDL No:MFCD28401038
Product Description
Catalog Number:
AG001M5N
Chemical Name:
Pyrimidine, 4-chloro-6-(methoxymethyl)-2-(methylthio)-
CAS Number:
1499503-95-5
Molecular Formula:
C7H9ClN2OS
Molecular Weight:
204.6772
MDL Number:
MFCD28401038
IUPAC Name:
4-chloro-6-(methoxymethyl)-2-methylsulfanylpyrimidine
InChI:
InChI=1S/C7H9ClN2OS/c1-11-4-5-3-6(8)10-7(9-5)12-2/h3H,4H2,1-2H3
InChI Key:
RWBYNJVGRHNTJB-UHFFFAOYSA-N
SMILES:
COCc1cc(Cl)nc(n1)SC
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.012g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.672g/mol
Monoisotopic Mass:
204.012g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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