Home Carboxys 4-Nitro-2-thiophenecarboxylic acid

4-Nitro-2-thiophenecarboxylic acid

CAS No.:
13138-70-0
Catalog Number:
AG000W2O
Molecular Formula:
C5H3NO4S
Molecular Weight:
173.1466
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$260
- +
Product Description
Catalog Number:
AG000W2O
Chemical Name:
4-Nitro-2-thiophenecarboxylic acid
CAS Number:
13138-70-0
Molecular Formula:
C5H3NO4S
Molecular Weight:
173.1466
MDL Number:
MFCD07787605
IUPAC Name:
4-nitrothiophene-2-carboxylic acid
InChI:
InChI=1S/C5H3NO4S/c7-5(8)4-1-3(2-11-4)6(9)10/h1-2H,(H,7,8)
InChI Key:
SZHKHACZQDMGGI-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1csc(c1)C(=O)O
NSC Number:
108994
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.978g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
173.142g/mol
Monoisotopic Mass:
172.978g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties