Home Halogens Benzeneacetic acid, 5-chloro-2-nitro-

Benzeneacetic acid, 5-chloro-2-nitro-

CAS No.:
22908-28-7
Catalog Number:
AG002LFL
Molecular Formula:
C8H6ClNO4
Molecular Weight:
215.5905
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Product Description
Catalog Number:
AG002LFL
Chemical Name:
Benzeneacetic acid, 5-chloro-2-nitro-
CAS Number:
22908-28-7
Molecular Formula:
C8H6ClNO4
Molecular Weight:
215.5905
MDL Number:
MFCD03206465
IUPAC Name:
2-(5-chloro-2-nitrophenyl)acetic acid
InChI:
InChI=1S/C8H6ClNO4/c9-6-1-2-7(10(13)14)5(3-6)4-8(11)12/h1-3H,4H2,(H,11,12)
InChI Key:
ISSGDBWGQCOTNA-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cc(Cl)ccc1[N+](=O)[O-]
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.999g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.589g/mol
Monoisotopic Mass:
214.999g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties