Home Other Building Blocks 4-Acetoxybenzoic acid

4-Acetoxybenzoic acid

CAS No.:
2345-34-8
Catalog Number:
AG002NA4
Molecular Formula:
C9H8O4
Molecular Weight:
180.1574
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$19
- +
25g
95%
In Stock USA
United States
$45
- +
100g
95%
In Stock USA
United States
$125
- +
500g
95%
In Stock USA
United States
$335
- +
Product Description
Catalog Number:
AG002NA4
Chemical Name:
4-Acetoxybenzoic acid
CAS Number:
2345-34-8
Molecular Formula:
C9H8O4
Molecular Weight:
180.1574
MDL Number:
MFCD00002540
IUPAC Name:
4-acetyloxybenzoic acid
InChI:
InChI=1S/C9H8O4/c1-6(10)13-8-4-2-7(3-5-8)9(11)12/h2-5H,1H3,(H,11,12)
InChI Key:
GDBUZIKSJGRBJP-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1ccc(cc1)C(=O)O
EC Number:
219-066-9
NSC Number:
11340
Properties
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.042g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.159g/mol
Monoisotopic Mass:
180.042g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties