Home Nitros 1,3-dimethoxy-5-[(E)-2-nitroprop-1-enyl]benzene

1,3-dimethoxy-5-[(E)-2-nitroprop-1-enyl]benzene

CAS No.:
128638-55-1
Catalog Number:
AG019ES6
Molecular Formula:
C11H13NO4
Molecular Weight:
223.2252
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019ES6
Chemical Name:
1,3-dimethoxy-5-[(E)-2-nitroprop-1-enyl]benzene
CAS Number:
128638-55-1
Molecular Formula:
C11H13NO4
Molecular Weight:
223.2252
MDL Number:
MFCD00052911
IUPAC Name:
1,3-dimethoxy-5-(2-nitroprop-1-enyl)benzene
InChI:
InChI=1S/C11H13NO4/c1-8(12(13)14)4-9-5-10(15-2)7-11(6-9)16-3/h4-7H,1-3H3
InChI Key:
COWWUDOIMZXGFM-UHFFFAOYSA-N
SMILES:
COc1cc(/C=C(/[N+](=O)[O-])\C)cc(c1)OC
Properties
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.084g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.228g/mol
Monoisotopic Mass:
223.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.5  
Properties