Home Other Building Blocks 3-(Thiophen-2-yl)-3-(2,2,2-trifluoroacetamido)propanoic acid

3-(Thiophen-2-yl)-3-(2,2,2-trifluoroacetamido)propanoic acid

CAS No.:
115957-22-7
Catalog Number:
AG000H7V
Molecular Formula:
C9H8F3NO3S
Molecular Weight:
267.2249
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$170
- +
1g
1 week
United States
$303
- +
Product Description
Catalog Number:
AG000H7V
Chemical Name:
3-(Thiophen-2-yl)-3-(2,2,2-trifluoroacetamido)propanoic acid
CAS Number:
115957-22-7
Molecular Formula:
C9H8F3NO3S
Molecular Weight:
267.2249
MDL Number:
MFCD03001310
IUPAC Name:
3-thiophen-2-yl-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid
InChI:
InChI=1S/C9H8F3NO3S/c10-9(11,12)8(16)13-5(4-7(14)15)6-2-1-3-17-6/h1-3,5H,4H2,(H,13,16)(H,14,15)
InChI Key:
LAPSEFLUNMVPQL-UHFFFAOYSA-N
SMILES:
OC(=O)CC(c1cccs1)NC(=O)C(F)(F)F
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.018g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
267.222g/mol
Monoisotopic Mass:
267.018g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
94.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties