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Home > Imidazoles > 1520747-34-5
1520747-34-5 | 1-tert-butyl-1H-imidazo[4,5-c]pyridine-2-thiol
CAS No: 1520747-34-5 Catalog No: AG01DSJM MDL No:MFCD21841434
Product Description
Catalog Number:
AG01DSJM
Chemical Name:
1-tert-butyl-1H-imidazo[4,5-c]pyridine-2-thiol
CAS Number:
1520747-34-5
Molecular Formula:
C10H13N3S
Molecular Weight:
207.2953
MDL Number:
MFCD21841434
IUPAC Name:
1-tert-butyl-3H-imidazo[4,5-c]pyridine-2-thione
InChI:
InChI=1S/C10H13N3S/c1-10(2,3)13-8-4-5-11-6-7(8)12-9(13)14/h4-6H,1-3H3,(H,12,14)
InChI Key:
XYXQLLNARXPPAE-UHFFFAOYSA-N
SMILES:
Sc1nc2c(n1C(C)(C)C)ccnc2
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.083g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.295g/mol
Monoisotopic Mass:
207.083g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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