Home Carboxys 3-(Acetylamino)thiophene-2-carboxylic acid

3-(Acetylamino)thiophene-2-carboxylic acid

CAS No.:
50901-18-3
Catalog Number:
AG00D87P
Molecular Formula:
C7H7NO3S
Molecular Weight:
185.2004
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG00D87P
Chemical Name:
3-(Acetylamino)thiophene-2-carboxylic acid
CAS Number:
50901-18-3
Molecular Formula:
C7H7NO3S
Molecular Weight:
185.2004
MDL Number:
MFCD00101396
IUPAC Name:
3-acetamidothiophene-2-carboxylic acid
InChI:
InChI=1S/C7H7NO3S/c1-4(9)8-5-2-3-12-6(5)7(10)11/h2-3H,1H3,(H,8,9)(H,10,11)
InChI Key:
LLKLTQJOEPWBOE-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccsc1C(=O)O
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.015g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
185.197g/mol
Monoisotopic Mass:
185.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
94.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties