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Methyl 5-methylpyrazine-2-carboxylate

CAS No.:
41110-33-2
Catalog Number:
AG0037GT
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$34
- +
25g
98%
In Stock USA
United States
$107
- +
100g
98%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG0037GT
Chemical Name:
Methyl 5-methylpyrazine-2-carboxylate
CAS Number:
41110-33-2
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
MDL Number:
MFCD04116910
IUPAC Name:
methyl 5-methylpyrazine-2-carboxylate
InChI:
InChI=1S/C7H8N2O2/c1-5-3-9-6(4-8-5)7(10)11-2/h3-4H,1-2H3
InChI Key:
CRBOSZMVDHYLJE-UHFFFAOYSA-N
SMILES:
COC(=O)c1cnc(cn1)C
EC Number:
620-310-5
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.059g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.153g/mol
Monoisotopic Mass:
152.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Literature
Title Journal
Quantitative structure-activity relationships for the in vitro antimycobacterial activity of pyrazinoic acid esters. Journal of medicinal chemistry 19960816
Pyrazinoic acid esters with broad spectrum in vitro antimycobacterial activity. Journal of medicinal chemistry 19950929
Properties