Home Halogens 3-Acetamido-5-bromobenzoic acid

3-Acetamido-5-bromobenzoic acid

CAS No.:
78238-11-6
Catalog Number:
AG005NIM
Molecular Formula:
C9H8BrNO3
Molecular Weight:
258.0687
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG005NIM
Chemical Name:
3-Acetamido-5-bromobenzoic acid
CAS Number:
78238-11-6
Molecular Formula:
C9H8BrNO3
Molecular Weight:
258.0687
MDL Number:
MFCD01098204
IUPAC Name:
3-acetamido-5-bromobenzoic acid
InChI:
InChI=1S/C9H8BrNO3/c1-5(12)11-8-3-6(9(13)14)2-7(10)4-8/h2-4H,1H3,(H,11,12)(H,13,14)
InChI Key:
LDQYJSYWTYAMBA-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc(Br)cc(c1)C(=O)O
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.969g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
258.071g/mol
Monoisotopic Mass:
256.969g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties