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Home Halogens Sodium p-chlorobenzoate

Sodium p-chlorobenzoate

CAS No.:
3686-66-6
Catalog Number:
AG00BZC6
Molecular Formula:
C7H4ClNaO2
Molecular Weight:
178.5482
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$57
- +
100g
98%
In Stock USA
United States
$157
- +
500g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG00BZC6
Chemical Name:
Sodium p-chlorobenzoate
CAS Number:
3686-66-6
Molecular Formula:
C7H4ClNaO2
Molecular Weight:
178.5482
MDL Number:
MFCD00016523
IUPAC Name:
sodium;4-chlorobenzoate
InChI:
InChI=1S/C7H5ClO2.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4H,(H,9,10);/q;+1/p-1
InChI Key:
GHMWZRWCBLXYBX-UHFFFAOYSA-M
SMILES:
[O-]C(=O)c1ccc(cc1)Cl.[Na+]
EC Number:
609-302-2
UNII:
WLB6A4A792
Properties
Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.98g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.547g/mol
Monoisotopic Mass:
177.98g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Carbonic anhydrase inhibitors. Inhibition of the β-class enzymes from the fungal pathogens Candida albicans and Cryptococcus neoformans with branched aliphatic/aromatic carboxylates and their derivatives. Bioorganic & medicinal chemistry letters 20110415
Properties