Home Halogens 2-Amino-4-bromo-5-fluoro-benzoic acid methyl ester

2-Amino-4-bromo-5-fluoro-benzoic acid methyl ester

CAS No.:
1395493-30-7
Catalog Number:
AG001B8M
Molecular Formula:
C8H7BrFNO2
Molecular Weight:
248.0491
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
25g
98%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG001B8M
Chemical Name:
2-Amino-4-bromo-5-fluoro-benzoic acid methyl ester
CAS Number:
1395493-30-7
Molecular Formula:
C8H7BrFNO2
Molecular Weight:
248.0491
MDL Number:
MFCD22565660
IUPAC Name:
methyl 2-amino-4-bromo-5-fluorobenzoate
InChI:
InChI=1S/C8H7BrFNO2/c1-13-8(12)4-2-6(10)5(9)3-7(4)11/h2-3H,11H2,1H3
InChI Key:
OVHIPEYONTVANB-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(F)c(cc1N)Br
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.964g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.051g/mol
Monoisotopic Mass:
246.964g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties