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169205-98-5 | Oxazolo[5,4-c]pyridine-2(1H)-thione
CAS No: 169205-98-5 Catalog No: AG001YLC MDL No:
Product Description
Catalog Number:
AG001YLC
Chemical Name:
Oxazolo[5,4-c]pyridine-2(1H)-thione
CAS Number:
169205-98-5
Molecular Formula:
C6H4N2OS
Molecular Weight:
152.1738
IUPAC Name:
1H-[1,3]oxazolo[5,4-c]pyridine-2-thione
InChI:
InChI=1S/C6H4N2OS/c10-6-8-4-1-2-7-3-5(4)9-6/h1-3H,(H,8,10)
InChI Key:
XNJNQCOGXNEEHD-UHFFFAOYSA-N
SMILES:
S=c1oc2c([nH]1)ccnc2
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.004g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.171g/mol
Monoisotopic Mass:
152.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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