Home Halogens Methyl 2-(5-chloro-2-nitrophenyl)-2-cyanoacetate

Methyl 2-(5-chloro-2-nitrophenyl)-2-cyanoacetate

CAS No.:
389571-34-0
Catalog Number:
AG00CLNS
Molecular Formula:
C10H7ClN2O4
Molecular Weight:
254.6266
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$63
- +
25g
98%
In Stock USA
United States
$188
- +
100g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG00CLNS
Chemical Name:
Methyl 2-(5-chloro-2-nitrophenyl)-2-cyanoacetate
CAS Number:
389571-34-0
Molecular Formula:
C10H7ClN2O4
Molecular Weight:
254.6266
MDL Number:
MFCD22383661
IUPAC Name:
methyl 2-(5-chloro-2-nitrophenyl)-2-cyanoacetate
InChI:
InChI=1S/C10H7ClN2O4/c1-17-10(14)8(5-12)7-4-6(11)2-3-9(7)13(15)16/h2-4,8H,1H3
InChI Key:
KWVVCRSFXUOEKY-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1C(C(=O)OC)C#N)Cl
Properties
Complexity:
359  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.009g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.626g/mol
Monoisotopic Mass:
254.009g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties