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Home Nitros 3-(4-Hydroxy-3-nitrophenyl)propanoic acid

3-(4-Hydroxy-3-nitrophenyl)propanoic acid

CAS No.:
38196-09-7
Catalog Number:
AG00BZIM
Molecular Formula:
C9H9NO5
Molecular Weight:
211.1715
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$125
- +
1g
95%
In Stock USA
United States
$313
- +
Product Description
Catalog Number:
AG00BZIM
Chemical Name:
3-(4-Hydroxy-3-nitrophenyl)propanoic acid
CAS Number:
38196-09-7
Molecular Formula:
C9H9NO5
Molecular Weight:
211.1715
MDL Number:
MFCD00045947
IUPAC Name:
3-(4-hydroxy-3-nitrophenyl)propanoic acid
InChI:
InChI=1S/C9H9NO5/c11-8-3-1-6(2-4-9(12)13)5-7(8)10(14)15/h1,3,5,11H,2,4H2,(H,12,13)
InChI Key:
KPJMKEOLALLMDY-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1ccc(c(c1)[N+](=O)[O-])O
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.048g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
211.173g/mol
Monoisotopic Mass:
211.048g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
Title Journal
Nitration activates tyrosine toward reaction with the hydrated electron. Radiation research 20110701
Properties