Home Halogens Methyl 4-amino-3-chloro-5-nitrobenzoate

Methyl 4-amino-3-chloro-5-nitrobenzoate

CAS No.:
863886-04-8
Catalog Number:
AG004OC1
Molecular Formula:
C8H7ClN2O4
Molecular Weight:
230.6052
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$50
- +
5g
97%
In Stock USA
United States
$150
- +
10g
97%
In Stock USA
United States
$263
- +
25g
97%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG004OC1
Chemical Name:
Methyl 4-amino-3-chloro-5-nitrobenzoate
CAS Number:
863886-04-8
Molecular Formula:
C8H7ClN2O4
Molecular Weight:
230.6052
MDL Number:
MFCD09842615
IUPAC Name:
methyl 4-amino-3-chloro-5-nitrobenzoate
InChI:
InChI=1S/C8H7ClN2O4/c1-15-8(12)4-2-5(9)7(10)6(3-4)11(13)14/h2-3H,10H2,1H3
InChI Key:
ZJFONSIKILEGMQ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Cl)c(c(c1)[N+](=O)[O-])N
Properties
Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.009g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.604g/mol
Monoisotopic Mass:
230.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
98.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties