Home Nitros Methanone, (4-methoxy-3-nitrophenyl)-2-thienyl-

Methanone, (4-methoxy-3-nitrophenyl)-2-thienyl-

CAS No.:
66938-50-9
Catalog Number:
AG006NE0
Molecular Formula:
C12H9NO4S
Molecular Weight:
263.2692
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Product Description
Catalog Number:
AG006NE0
Chemical Name:
Methanone, (4-methoxy-3-nitrophenyl)-2-thienyl-
CAS Number:
66938-50-9
Molecular Formula:
C12H9NO4S
Molecular Weight:
263.2692
MDL Number:
MFCD11215447
IUPAC Name:
(4-methoxy-3-nitrophenyl)-thiophen-2-ylmethanone
InChI:
InChI=1S/C12H9NO4S/c1-17-10-5-4-8(7-9(10)13(15)16)12(14)11-3-2-6-18-11/h2-7H,1H3
InChI Key:
GDBFHFJAGCNLJV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1[N+](=O)[O-])C(=O)c1cccs1
Properties
Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.025g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.267g/mol
Monoisotopic Mass:
263.025g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties