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Home Halogens Methyl 2-(5-bromo-4-chloro-2-nitrophenyl)-2-cyanoacetate

Methyl 2-(5-bromo-4-chloro-2-nitrophenyl)-2-cyanoacetate

CAS No.:
1393441-88-7
Catalog Number:
AG009WYL
Molecular Formula:
C10H6BrClN2O4
Molecular Weight:
333.5226
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$75
- +
25g
98%
In Stock USA
United States
$188
- +
100g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG009WYL
Chemical Name:
Methyl 2-(5-bromo-4-chloro-2-nitrophenyl)-2-cyanoacetate
CAS Number:
1393441-88-7
Molecular Formula:
C10H6BrClN2O4
Molecular Weight:
333.5226
MDL Number:
MFCD22383656
IUPAC Name:
methyl 2-(5-bromo-4-chloro-2-nitrophenyl)-2-cyanoacetate
InChI:
InChI=1S/C10H6BrClN2O4/c1-18-10(15)6(4-13)5-2-7(11)8(12)3-9(5)14(16)17/h2-3,6H,1H3
InChI Key:
MDXNPQYBWWSCHR-UHFFFAOYSA-N
SMILES:
N#CC(c1cc(Br)c(cc1[N+](=O)[O-])Cl)C(=O)OC
Properties
Complexity:
391  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.92g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
333.522g/mol
Monoisotopic Mass:
331.92g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties