Home Carboxys 5-(4-Nitrophenyl)thiophene-2-carboxylic acid

5-(4-Nitrophenyl)thiophene-2-carboxylic acid

CAS No.:
80387-79-7
Catalog Number:
AG0053CS
Molecular Formula:
C11H7NO4S
Molecular Weight:
249.2426
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$129
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG0053CS
Chemical Name:
5-(4-Nitrophenyl)thiophene-2-carboxylic acid
CAS Number:
80387-79-7
Molecular Formula:
C11H7NO4S
Molecular Weight:
249.2426
MDL Number:
MFCD00451599
IUPAC Name:
5-(4-nitrophenyl)thiophene-2-carboxylic acid
InChI:
InChI=1S/C11H7NO4S/c13-11(14)10-6-5-9(17-10)7-1-3-8(4-2-7)12(15)16/h1-6H,(H,13,14)
InChI Key:
KQLUSGVTGAPFDW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)c1ccc(s1)C(=O)O
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.01g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
249.24g/mol
Monoisotopic Mass:
249.01g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties