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Home > Pyridines > 1016888-06-4
1016888-06-4 | 6-(propan-2-yloxy)pyridine-3-carbothioamide
CAS No: 1016888-06-4 Catalog No: AG01BF5M MDL No:MFCD09942730
Product Description
Catalog Number:
AG01BF5M
Chemical Name:
6-(propan-2-yloxy)pyridine-3-carbothioamide
CAS Number:
1016888-06-4
Molecular Formula:
C9H12N2OS
Molecular Weight:
196.2694
MDL Number:
MFCD09942730
IUPAC Name:
6-propan-2-yloxypyridine-3-carbothioamide
InChI:
InChI=1S/C9H12N2OS/c1-6(2)12-8-4-3-7(5-11-8)9(10)13/h3-6H,1-2H3,(H2,10,13)
InChI Key:
ZGIBMBNFHRKDQE-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cn1)C(=S)N)C
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.268g/mol
Monoisotopic Mass:
196.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
80.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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