Home Halogens 2-[(6-chloropyrazin-2-yl)oxy]acetic acid

2-[(6-chloropyrazin-2-yl)oxy]acetic acid

CAS No.:
1080650-29-8
Catalog Number:
AG01AF7K
Molecular Formula:
C6H5ClN2O3
Molecular Weight:
188.5685
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Product Description
Catalog Number:
AG01AF7K
Chemical Name:
2-[(6-chloropyrazin-2-yl)oxy]acetic acid
CAS Number:
1080650-29-8
Molecular Formula:
C6H5ClN2O3
Molecular Weight:
188.5685
MDL Number:
MFCD20660485
IUPAC Name:
2-(6-chloropyrazin-2-yl)oxyacetic acid
InChI:
InChI=1S/C6H5ClN2O3/c7-4-1-8-2-5(9-4)12-3-6(10)11/h1-2H,3H2,(H,10,11)
InChI Key:
UHGGLVGAAJWJIS-UHFFFAOYSA-N
SMILES:
OC(=O)COc1cncc(n1)Cl
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.999g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.567g/mol
Monoisotopic Mass:
187.999g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties