Home Halogens 4-Amino-3-bromobenzoic acid

4-Amino-3-bromobenzoic acid

CAS No.:
6311-37-1
Catalog Number:
AG00E9BT
Molecular Formula:
C7H6BrNO2
Molecular Weight:
216.0320
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$38
- +
25g
98%
In Stock USA
United States
$125
- +
100g
98%
In Stock USA
United States
$313
- +
Product Description
Catalog Number:
AG00E9BT
Chemical Name:
4-Amino-3-bromobenzoic acid
CAS Number:
6311-37-1
Molecular Formula:
C7H6BrNO2
Molecular Weight:
216.0320
MDL Number:
MFCD03407439
IUPAC Name:
4-amino-3-bromobenzoic acid
InChI:
InChI=1S/C7H6BrNO2/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3H,9H2,(H,10,11)
InChI Key:
BFIVZIVVJNFTIQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)Br)N
NSC Number:
43549
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.958g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
216.034g/mol
Monoisotopic Mass:
214.958g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
4-Amino-3-bromo-benzoic acid. Acta crystallographica. Section E, Structure reports online 20090301
Properties