Home Halogens Methyl 6-chloronicotinate

Methyl 6-chloronicotinate

CAS No.:
73781-91-6
Catalog Number:
AG003RYF
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$32
- +
100g
98%
In Stock USA
United States
$94
- +
Product Description
Catalog Number:
AG003RYF
Chemical Name:
Methyl 6-chloronicotinate
CAS Number:
73781-91-6
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
MDL Number:
MFCD00023420
IUPAC Name:
methyl 6-chloropyridine-3-carboxylate
InChI:
InChI=1S/C7H6ClNO2/c1-11-7(10)5-2-3-6(8)9-4-5/h2-4H,1H3
InChI Key:
RMEDXVIWDFLGES-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(nc1)Cl
NSC Number:
78316
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.009g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.58g/mol
Monoisotopic Mass:
171.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Methyl 6-chloro-nicotinate. Acta crystallographica. Section E, Structure reports online 20120101
Properties