Home Carboxys Methyl 5-methyl-4-nitrothiophene-2-carboxylate

Methyl 5-methyl-4-nitrothiophene-2-carboxylate

CAS No.:
56921-01-8
Catalog Number:
AG00IA5J
Molecular Formula:
C7H7NO4S
Molecular Weight:
201.1998
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$150
- +
1g
96%
In Stock USA
United States
$300
- +
5g
96%
In Stock USA
United States
$775
- +
Product Description
Catalog Number:
AG00IA5J
Chemical Name:
Methyl 5-methyl-4-nitrothiophene-2-carboxylate
CAS Number:
56921-01-8
Molecular Formula:
C7H7NO4S
Molecular Weight:
201.1998
MDL Number:
MFCD18642553
IUPAC Name:
methyl 5-methyl-4-nitrothiophene-2-carboxylate
InChI:
InChI=1S/C7H7NO4S/c1-4-5(8(10)11)3-6(13-4)7(9)12-2/h3H,1-2H3
InChI Key:
QXIFGUCZQLEFBZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1sc(c(c1)[N+](=O)[O-])C
NSC Number:
108993
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.01g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.196g/mol
Monoisotopic Mass:
201.01g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties