Home Nitros Methyl 2,3,4-trifluoro-5-nitrobenzoate

Methyl 2,3,4-trifluoro-5-nitrobenzoate

CAS No.:
918321-24-1
Catalog Number:
AG01DKJO
Molecular Formula:
C8H4F3NO4
Molecular Weight:
235.1169
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$48
- +
1g
95%
In Stock USA
United States
$95
- +
5g
95%
In Stock USA
United States
$243
- +
Product Description
Catalog Number:
AG01DKJO
Chemical Name:
Methyl 2,3,4-trifluoro-5-nitrobenzoate
CAS Number:
918321-24-1
Molecular Formula:
C8H4F3NO4
Molecular Weight:
235.1169
MDL Number:
MFCD13248633
IUPAC Name:
methyl 2,3,4-trifluoro-5-nitrobenzoate
InChI:
InChI=1S/C8H4F3NO4/c1-16-8(13)3-2-4(12(14)15)6(10)7(11)5(3)9/h2H,1H3
InChI Key:
KLHGRWQHRLWLEB-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc([N+](=O)[O-])c(c(c1F)F)F
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.009g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.118g/mol
Monoisotopic Mass:
235.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties