Home Halogens 4-Amino-2-chlorobenzoic acid

4-Amino-2-chlorobenzoic acid

CAS No.:
2457-76-3
Catalog Number:
AG002OLQ
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$15
- +
25g
98%
In Stock USA
United States
$35
- +
100g
98%
In Stock USA
United States
$95
- +
500g
98%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG002OLQ
Chemical Name:
4-Amino-2-chlorobenzoic acid
CAS Number:
2457-76-3
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
MDL Number:
MFCD00007772
IUPAC Name:
4-amino-2-chlorobenzoic acid
InChI:
InChI=1S/C7H6ClNO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,9H2,(H,10,11)
InChI Key:
MBDUKNCPOPMRJQ-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)Cl)C(=O)O
EC Number:
219-540-5
UNII:
Y3S6924IA6
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.009g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
171.58g/mol
Monoisotopic Mass:
171.009g/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-2-chloro-benzoic acid. Acta crystallographica. Section E, Structure reports online 20110901
Properties