Home Halogens Methyl 5-amino-2-bromo-4-fluorobenzoate

Methyl 5-amino-2-bromo-4-fluorobenzoate

CAS No.:
1036389-86-2
Catalog Number:
AG008W7U
Molecular Formula:
C8H7BrFNO2
Molecular Weight:
248.0491
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$350
- +
5g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG008W7U
Chemical Name:
Methyl 5-amino-2-bromo-4-fluorobenzoate
CAS Number:
1036389-86-2
Molecular Formula:
C8H7BrFNO2
Molecular Weight:
248.0491
MDL Number:
MFCD17128522
IUPAC Name:
methyl 5-amino-2-bromo-4-fluorobenzoate
InChI:
InChI=1S/C8H7BrFNO2/c1-13-8(12)4-2-7(11)6(10)3-5(4)9/h2-3H,11H2,1H3
InChI Key:
QMTDDCURRBENGD-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(N)c(cc1Br)F
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:
1.9  
Properties