Home Halogens 5-chloro-6-(ethylamino)pyridine-3-carboxylic acid

5-chloro-6-(ethylamino)pyridine-3-carboxylic acid

CAS No.:
1019461-54-1
Catalog Number:
AG01BI4K
Molecular Formula:
C8H9ClN2O2
Molecular Weight:
200.6223
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Product Description
Catalog Number:
AG01BI4K
Chemical Name:
5-chloro-6-(ethylamino)pyridine-3-carboxylic acid
CAS Number:
1019461-54-1
Molecular Formula:
C8H9ClN2O2
Molecular Weight:
200.6223
MDL Number:
MFCD11132028
IUPAC Name:
5-chloro-6-(ethylamino)pyridine-3-carboxylic acid
InChI:
InChI=1S/C8H9ClN2O2/c1-2-10-7-6(9)3-5(4-11-7)8(12)13/h3-4H,2H2,1H3,(H,10,11)(H,12,13)
InChI Key:
AQUHMSXUKOCEPD-UHFFFAOYSA-N
SMILES:
CCNc1ncc(cc1Cl)C(=O)O
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.035g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
200.622g/mol
Monoisotopic Mass:
200.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties