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Home > Pyridines > 2092121-86-1
2092121-86-1 | 1-[3-(pyridin-4-yl)thiophen-2-yl]ethan-1-one
CAS No: 2092121-86-1 Catalog No: AG01C9YQ MDL No:
Product Description
Catalog Number:
AG01C9YQ
Chemical Name:
1-[3-(pyridin-4-yl)thiophen-2-yl]ethan-1-one
CAS Number:
2092121-86-1
Molecular Formula:
C11H9NOS
Molecular Weight:
203.2603
IUPAC Name:
1-(3-pyridin-4-ylthiophen-2-yl)ethanone
InChI:
InChI=1S/C11H9NOS/c1-8(13)11-10(4-7-14-11)9-2-5-12-6-3-9/h2-7H,1H3
InChI Key:
XTZGBKCIWPHJIF-UHFFFAOYSA-N
SMILES:
CC(=O)c1sccc1c1ccncc1
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.04g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.259g/mol
Monoisotopic Mass:
203.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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