Home Carboxys 5-Acetylthiophene-3-carboxylic acid

5-Acetylthiophene-3-carboxylic acid

CAS No.:
33148-86-6
Catalog Number:
AG007HA4
Molecular Formula:
C7H6O3S
Molecular Weight:
170.1857
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$289
- +
5g
95%
In Stock USA
United States
$858
- +
Product Description
Catalog Number:
AG007HA4
Chemical Name:
5-Acetylthiophene-3-carboxylic acid
CAS Number:
33148-86-6
Molecular Formula:
C7H6O3S
Molecular Weight:
170.1857
MDL Number:
MFCD07643214
IUPAC Name:
5-acetylthiophene-3-carboxylic acid
InChI:
InChI=1S/C7H6O3S/c1-4(8)6-2-5(3-11-6)7(9)10/h2-3H,1H3,(H,9,10)
InChI Key:
GSPVECVNXXJOGI-UHFFFAOYSA-N
SMILES:
OC(=O)c1csc(c1)C(=O)C
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.004g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.182g/mol
Monoisotopic Mass:
170.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
82.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties