Home Nitros 2,4-Dimethoxy-5-nitrobenzoic acid

2,4-Dimethoxy-5-nitrobenzoic acid

CAS No.:
90564-41-3
Catalog Number:
AG003FTI
Molecular Formula:
C9H9NO6
Molecular Weight:
227.1709
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$313
- +
5g
98%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG003FTI
Chemical Name:
2,4-Dimethoxy-5-nitrobenzoic acid
CAS Number:
90564-41-3
Molecular Formula:
C9H9NO6
Molecular Weight:
227.1709
MDL Number:
MFCD12173036
IUPAC Name:
2,4-dimethoxy-5-nitrobenzoic acid
InChI:
InChI=1S/C9H9NO6/c1-15-7-4-8(16-2)6(10(13)14)3-5(7)9(11)12/h3-4H,1-2H3,(H,11,12)
InChI Key:
RECRLCHPXXOYHZ-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c(cc1[N+](=O)[O-])C(=O)O
Properties
Complexity:
276  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.043g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.172g/mol
Monoisotopic Mass:
227.043g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties