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120208-25-5 | Oxazolo[4,5-c]pyridine, 2-(methylthio)-
CAS No: 120208-25-5 Catalog No: AG00HFB3 MDL No:MFCD12024840
Product Description
Catalog Number:
AG00HFB3
Chemical Name:
Oxazolo[4,5-c]pyridine, 2-(methylthio)-
CAS Number:
120208-25-5
Molecular Formula:
C7H6N2OS
Molecular Weight:
166.2003
MDL Number:
MFCD12024840
IUPAC Name:
2-methylsulfanyl-[1,3]oxazolo[4,5-c]pyridine
InChI:
InChI=1S/C7H6N2OS/c1-11-7-9-5-4-8-3-2-6(5)10-7/h2-4H,1H3
InChI Key:
NARDLOOJGQUXQV-UHFFFAOYSA-N
SMILES:
CSc1nc2c(o1)ccnc2
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.02g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.198g/mol
Monoisotopic Mass:
166.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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