Home Nitros (5-Methyl-3-nitropyridin-2-yl)acetic acid

(5-Methyl-3-nitropyridin-2-yl)acetic acid

CAS No.:
1214386-16-9
Catalog Number:
AG00HG84
Molecular Formula:
C8H8N2O4
Molecular Weight:
196.1601
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$313
- +
5g
95%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG00HG84
Chemical Name:
(5-Methyl-3-nitropyridin-2-yl)acetic acid
CAS Number:
1214386-16-9
Molecular Formula:
C8H8N2O4
Molecular Weight:
196.1601
MDL Number:
MFCD13194542
IUPAC Name:
2-(5-methyl-3-nitropyridin-2-yl)acetic acid
InChI:
InChI=1S/C8H8N2O4/c1-5-2-7(10(13)14)6(9-4-5)3-8(11)12/h2,4H,3H2,1H3,(H,11,12)
InChI Key:
KFSNHIHTLVXZEA-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ncc(cc1[N+](=O)[O-])C
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.048g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.162g/mol
Monoisotopic Mass:
196.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties