Home Nitros (4-Chloro-2-nitrophenoxy)acetic acid

(4-Chloro-2-nitrophenoxy)acetic acid

CAS No.:
21086-49-7
Catalog Number:
AG002L0V
Molecular Formula:
C8H6ClNO5
Molecular Weight:
231.5899
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$226
- +
5g
95%
In Stock USA
United States
$671
- +
Product Description
Catalog Number:
AG002L0V
Chemical Name:
(4-Chloro-2-nitrophenoxy)acetic acid
CAS Number:
21086-49-7
Molecular Formula:
C8H6ClNO5
Molecular Weight:
231.5899
MDL Number:
MFCD03422208
IUPAC Name:
2-(4-chloro-2-nitrophenoxy)acetic acid
InChI:
InChI=1S/C8H6ClNO5/c9-5-1-2-7(15-4-8(11)12)6(3-5)10(13)14/h1-3H,4H2,(H,11,12)
InChI Key:
JYCUJLCLZHPKMS-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccc(cc1[N+](=O)[O-])Cl
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.993g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.588g/mol
Monoisotopic Mass:
230.993g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties