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Home Nitros N-Acetyl-s-(4-nitrophenyl)-l-cysteine

N-Acetyl-s-(4-nitrophenyl)-l-cysteine

CAS No.:
91088-55-0
Catalog Number:
AG006EZI
Molecular Formula:
C11H12N2O5S
Molecular Weight:
284.2884
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
>98.0%(T)
1 week
United States
$282
- +
Product Description
Catalog Number:
AG006EZI
Chemical Name:
N-Acetyl-s-(4-nitrophenyl)-l-cysteine
CAS Number:
91088-55-0
Molecular Formula:
C11H12N2O5S
Molecular Weight:
284.2884
MDL Number:
MFCD00671484
IUPAC Name:
(2R)-2-acetamido-3-(4-nitrophenyl)sulfanylpropanoic acid
InChI:
InChI=1S/C11H12N2O5S/c1-7(14)12-10(11(15)16)6-19-9-4-2-8(3-5-9)13(17)18/h2-5,10H,6H2,1H3,(H,12,14)(H,15,16)/t10-/m0/s1
InChI Key:
LOBKSYPZBSVLLE-JTQLQIEISA-N
SMILES:
CC(=O)N[C@H](C(=O)O)CSc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
284.047g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
284.286g/mol
Monoisotopic Mass:
284.047g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Urinary metabolites and health effects in workers exposed chronically to chloronitrobenzene. Biomarkers : biochemical indicators of exposure, response, and susceptibility to chemicals 20070101
Properties