Home Halogens ethyl 6-chloro-5-cyanopyridine-2-carboxylate

ethyl 6-chloro-5-cyanopyridine-2-carboxylate

CAS No.:
1780335-83-2
Catalog Number:
AG01DYW5
Molecular Formula:
C9H7ClN2O2
Molecular Weight:
210.6171
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Product Description
Catalog Number:
AG01DYW5
Chemical Name:
ethyl 6-chloro-5-cyanopyridine-2-carboxylate
CAS Number:
1780335-83-2
Molecular Formula:
C9H7ClN2O2
Molecular Weight:
210.6171
MDL Number:
MFCD28749714
IUPAC Name:
ethyl 6-chloro-5-cyanopyridine-2-carboxylate
InChI:
InChI=1S/C9H7ClN2O2/c1-2-14-9(13)7-4-3-6(5-11)8(10)12-7/h3-4H,2H2,1H3
InChI Key:
KNDJEEFHGLNAHI-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(c(n1)Cl)C#N
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.617g/mol
Monoisotopic Mass:
210.02g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties