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Home Nitros 2,4-Dinitrophenylacetic acid

2,4-Dinitrophenylacetic acid

CAS No.:
643-43-6
Catalog Number:
AG003FV5
Molecular Formula:
C8H6N2O6
Molecular Weight:
226.1430
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$32
- +
25g
95%
In Stock USA
United States
$113
- +
100g
95%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG003FV5
Chemical Name:
2,4-Dinitrophenylacetic acid
CAS Number:
643-43-6
Molecular Formula:
C8H6N2O6
Molecular Weight:
226.1430
MDL Number:
MFCD00007227
IUPAC Name:
2-(2,4-dinitrophenyl)acetic acid
InChI:
InChI=1S/C8H6N2O6/c11-8(12)3-5-1-2-6(9(13)14)4-7(5)10(15)16/h1-2,4H,3H2,(H,11,12)
InChI Key:
KCNISYPADDTFDO-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
EC Number:
211-398-2
NSC Number:
6225
Properties
Complexity:
307  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.023g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.144g/mol
Monoisotopic Mass:
226.023g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Literature
Title Journal
Development of an oligo(ethylene glycol)-based SPR immunosensor for TNT detection. Biosensors & bioelectronics 20081015
A self-assembled nanofiber catalyst for ester hydrolysis. Journal of the American Chemical Society 20071010
Kinetic evidence for a substrate-induced fit in phosphonoacetaldehyde hydrolase catalysis. Biochemistry 20021112
Properties