Home Nitros 2-Methyl-2-(4-nitrophenoxy)propanoic acid

2-Methyl-2-(4-nitrophenoxy)propanoic acid

CAS No.:
17431-97-9
Catalog Number:
AG001ZLJ
Molecular Formula:
C10H11NO5
Molecular Weight:
225.1980
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$226
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Product Description
Catalog Number:
AG001ZLJ
Chemical Name:
2-Methyl-2-(4-nitrophenoxy)propanoic acid
CAS Number:
17431-97-9
Molecular Formula:
C10H11NO5
Molecular Weight:
225.1980
MDL Number:
MFCD03422282
IUPAC Name:
2-methyl-2-(4-nitrophenoxy)propanoic acid
InChI:
InChI=1S/C10H11NO5/c1-10(2,9(12)13)16-8-5-3-7(4-6-8)11(14)15/h3-6H,1-2H3,(H,12,13)
InChI Key:
ZGQMZVWPCVHENS-UHFFFAOYSA-N
SMILES:
OC(=O)C(Oc1ccc(cc1)[N+](=O)[O-])(C)C
NSC Number:
34009
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.064g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.2g/mol
Monoisotopic Mass:
225.064g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
Title Journal
2-Methyl-2-(4-nitro-phen-oxy)propanoic acid. Acta crystallographica. Section E, Structure reports online 20081201
Properties