Home Carboxys 5-Bromo-4-nitrothiophene-2-carboxylic acid

5-Bromo-4-nitrothiophene-2-carboxylic acid

CAS No.:
89283-24-9
Catalog Number:
AG0040QZ
Molecular Formula:
C5H2BrNO4S
Molecular Weight:
252.0427
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$305
- +
1g
97%
1 week
United States
$703
- +
Product Description
Catalog Number:
AG0040QZ
Chemical Name:
5-Bromo-4-nitrothiophene-2-carboxylic acid
CAS Number:
89283-24-9
Molecular Formula:
C5H2BrNO4S
Molecular Weight:
252.0427
MDL Number:
MFCD00582675
IUPAC Name:
5-bromo-4-nitrothiophene-2-carboxylic acid
InChI:
InChI=1S/C5H2BrNO4S/c6-4-2(7(10)11)1-3(12-4)5(8)9/h1H,(H,8,9)
InChI Key:
NTICRYSYQVALQQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(sc1Br)C(=O)O
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.889g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
252.038g/mol
Monoisotopic Mass:
250.889g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties