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Home Nitros (Z)-Methyl 2-cyano-2-(5-nitropyridin-2(1H)-ylidene)acetate

(Z)-Methyl 2-cyano-2-(5-nitropyridin-2(1H)-ylidene)acetate

CAS No.:
1221794-83-7
Catalog Number:
AG0016VS
Molecular Formula:
C9H7N3O4
Molecular Weight:
221.1696
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$150
- +
25g
98%
In Stock USA
United States
$450
- +
100g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG0016VS
Chemical Name:
(Z)-Methyl 2-cyano-2-(5-nitropyridin-2(1H)-ylidene)acetate
CAS Number:
1221794-83-7
Molecular Formula:
C9H7N3O4
Molecular Weight:
221.1696
MDL Number:
MFCD16036153
IUPAC Name:
methyl (2Z)-2-cyano-2-(5-nitro-1H-pyridin-2-ylidene)acetate
InChI:
InChI=1S/C9H7N3O4/c1-16-9(13)7(4-10)8-3-2-6(5-11-8)12(14)15/h2-3,5,11H,1H3/b8-7-
InChI Key:
YCCVKFVOTUBORA-FPLPWBNLSA-N
SMILES:
N#CC(=c1ccc(c[nH]1)[N+](=O)[O-])C(=O)OC
Properties
Complexity:
473  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
221.044g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.172g/mol
Monoisotopic Mass:
221.044g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties