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1174517-48-6 | Pyrazine, 2,3-dichloro-5-(methylthio)-
CAS No: 1174517-48-6 Catalog No: AG000EBM MDL No:MFCD22682762
Product Description
Catalog Number:
AG000EBM
Chemical Name:
Pyrazine, 2,3-dichloro-5-(methylthio)-
CAS Number:
1174517-48-6
Molecular Formula:
C5H4Cl2N2S
Molecular Weight:
195.0697
MDL Number:
MFCD22682762
IUPAC Name:
2,3-dichloro-5-methylsulfanylpyrazine
InChI:
InChI=1S/C5H4Cl2N2S/c1-10-3-2-8-4(6)5(7)9-3/h2H,1H3
InChI Key:
QZXHEYFNVBYHRD-UHFFFAOYSA-N
SMILES:
CSc1cnc(c(n1)Cl)Cl
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.947g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.061g/mol
Monoisotopic Mass:
193.947g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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