Home Nitros 1-(2-Methoxy-5-nitrophenyl)thiourea

1-(2-Methoxy-5-nitrophenyl)thiourea

CAS No.:
159753-14-7
Catalog Number:
AG001RDL
Molecular Formula:
C8H9N3O3S
Molecular Weight:
227.2404
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
In Stock USA
United States
$135
- +
5g
In Stock USA
United States
$255
- +
Product Description
Catalog Number:
AG001RDL
Chemical Name:
1-(2-Methoxy-5-nitrophenyl)thiourea
CAS Number:
159753-14-7
Molecular Formula:
C8H9N3O3S
Molecular Weight:
227.2404
MDL Number:
MFCD00060546
IUPAC Name:
(2-methoxy-5-nitrophenyl)thiourea
InChI:
InChI=1S/C8H9N3O3S/c1-14-7-3-2-5(11(12)13)4-6(7)10-8(9)15/h2-4H,1H3,(H3,9,10,15)
InChI Key:
XIOYSXKDIDOGPF-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1NC(=S)N)[N+](=O)[O-]
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.036g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
227.238g/mol
Monoisotopic Mass:
227.036g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties