Home Carboxys Methyl 3-(acetylamino)-5-nitrothiophene-2-carboxylate

Methyl 3-(acetylamino)-5-nitrothiophene-2-carboxylate

CAS No.:
80615-54-9
Catalog Number:
AG008M9R
Molecular Formula:
C8H8N2O5S
Molecular Weight:
244.2245
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$45
- +
250mg
95%
In Stock USA
United States
$79
- +
1g
95%
In Stock USA
United States
$158
- +
5g
95%
In Stock USA
United States
$473
- +
Product Description
Catalog Number:
AG008M9R
Chemical Name:
Methyl 3-(acetylamino)-5-nitrothiophene-2-carboxylate
CAS Number:
80615-54-9
Molecular Formula:
C8H8N2O5S
Molecular Weight:
244.2245
MDL Number:
MFCD11616107
IUPAC Name:
methyl 3-acetamido-5-nitrothiophene-2-carboxylate
InChI:
InChI=1S/C8H8N2O5S/c1-4(11)9-5-3-6(10(13)14)16-7(5)8(12)15-2/h3H,1-2H3,(H,9,11)
InChI Key:
DJPJTIGJPWASOS-UHFFFAOYSA-N
SMILES:
COC(=O)c1sc(cc1NC(=O)C)[N+](=O)[O-]
Properties
Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.015g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
244.221g/mol
Monoisotopic Mass:
244.015g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties