Home Halogens 4-Amino-3-bromo-5-iodo-benzoic acid ethyl ester

4-Amino-3-bromo-5-iodo-benzoic acid ethyl ester

CAS No.:
437707-51-2
Catalog Number:
AG00D827
Molecular Formula:
C9H9BrINO2
Molecular Weight:
369.9817
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$76
- +
1g
95%
In Stock USA
United States
$121
- +
5g
95%
In Stock USA
United States
$407
- +
10g
95%
In Stock USA
United States
$782
- +
25g
95%
In Stock USA
United States
$1572
- +
Product Description
Catalog Number:
AG00D827
Chemical Name:
4-Amino-3-bromo-5-iodo-benzoic acid ethyl ester
CAS Number:
437707-51-2
Molecular Formula:
C9H9BrINO2
Molecular Weight:
369.9817
MDL Number:
MFCD06658437
IUPAC Name:
ethyl 4-amino-3-bromo-5-iodobenzoate
InChI:
InChI=1S/C9H9BrINO2/c1-2-14-9(13)5-3-6(10)8(12)7(11)4-5/h3-4H,2,12H2,1H3
InChI Key:
AOHVATDJDHOIRV-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(Br)c(c(c1)I)N
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.886g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
369.984g/mol
Monoisotopic Mass:
368.886g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties