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125035-34-9 | Methanone, (2-chloro-3-pyridinyl)-2-thienyl-
CAS No: 125035-34-9 Catalog No: AG000N0E MDL No:MFCD02260467
Product Description
Catalog Number:
AG000N0E
Chemical Name:
Methanone, (2-chloro-3-pyridinyl)-2-thienyl-
CAS Number:
125035-34-9
Molecular Formula:
C10H6ClNOS
Molecular Weight:
223.6787
MDL Number:
MFCD02260467
IUPAC Name:
(2-chloropyridin-3-yl)-thiophen-2-ylmethanone
InChI:
InChI=1S/C10H6ClNOS/c11-10-7(3-1-5-12-10)9(13)8-4-2-6-14-8/h1-6H
InChI Key:
BOABLMHZQMXLBD-UHFFFAOYSA-N
SMILES:
Clc1ncccc1C(=O)c1cccs1
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.986g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.674g/mol
Monoisotopic Mass:
222.986g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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