Home Halogens 1-(5-chloro-6-methoxypyridin-3-yl)ethan-1-one

1-(5-chloro-6-methoxypyridin-3-yl)ethan-1-one

CAS No.:
1196152-96-1
Catalog Number:
AG01B9LM
Molecular Formula:
C8H8ClNO2
Molecular Weight:
185.6076
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Product Description
Catalog Number:
AG01B9LM
Chemical Name:
1-(5-chloro-6-methoxypyridin-3-yl)ethan-1-one
CAS Number:
1196152-96-1
Molecular Formula:
C8H8ClNO2
Molecular Weight:
185.6076
MDL Number:
MFCD13190368
IUPAC Name:
1-(5-chloro-6-methoxypyridin-3-yl)ethanone
InChI:
InChI=1S/C8H8ClNO2/c1-5(11)6-3-7(9)8(12-2)10-4-6/h3-4H,1-2H3
InChI Key:
IJYFRRQXGDJYDC-UHFFFAOYSA-N
SMILES:
COc1ncc(cc1Cl)C(=O)C
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.024g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.607g/mol
Monoisotopic Mass:
185.024g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties