Home Nitros 4-(3-Formyl-4-nitro-phenoxy)-butyric acid

4-(3-Formyl-4-nitro-phenoxy)-butyric acid

CAS No.:
94193-36-9
Catalog Number:
AG006P06
Molecular Formula:
C11H11NO6
Molecular Weight:
253.2081
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$100
- +
1g
98%
1 week
United States
$195
- +
5g
98%
1 week
United States
$364
- +
Product Description
Catalog Number:
AG006P06
Chemical Name:
4-(3-Formyl-4-nitro-phenoxy)-butyric acid
CAS Number:
94193-36-9
Molecular Formula:
C11H11NO6
Molecular Weight:
253.2081
MDL Number:
MFCD03001748
IUPAC Name:
4-(3-formyl-4-nitrophenoxy)butanoic acid
InChI:
InChI=1S/C11H11NO6/c13-7-8-6-9(3-4-10(8)12(16)17)18-5-1-2-11(14)15/h3-4,6-7H,1-2,5H2,(H,14,15)
InChI Key:
OQKITJICGXCHGS-UHFFFAOYSA-N
SMILES:
O=Cc1cc(OCCCC(=O)O)ccc1[N+](=O)[O-]
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.059g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
253.21g/mol
Monoisotopic Mass:
253.059g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties