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Home > Pyridines > 116538-95-5
116538-95-5 | Thieno[3,2-b]pyridine-6-carbonitrile (9CI)
CAS No: 116538-95-5 Catalog No: AG000CQ2 MDL No:MFCD11053768
Product Description
Catalog Number:
AG000CQ2
Chemical Name:
Thieno[3,2-b]pyridine-6-carbonitrile (9CI)
CAS Number:
116538-95-5
Molecular Formula:
C8H4N2S
Molecular Weight:
160.1958
MDL Number:
MFCD11053768
IUPAC Name:
thieno[3,2-b]pyridine-6-carbonitrile
InChI:
InChI=1S/C8H4N2S/c9-4-6-3-8-7(10-5-6)1-2-11-8/h1-3,5H
InChI Key:
QYCIXUKZMDUDBK-UHFFFAOYSA-N
SMILES:
N#Cc1cnc2c(c1)scc2
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.01g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.194g/mol
Monoisotopic Mass:
160.01g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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