Home Halogens Methyl 4-chloro-3-hydroxy-5-nitrobenzoate

Methyl 4-chloro-3-hydroxy-5-nitrobenzoate

CAS No.:
180031-12-3
Catalog Number:
AG00HZZW
Molecular Formula:
C8H6ClNO5
Molecular Weight:
231.5899
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$225
- +
1g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG00HZZW
Chemical Name:
Methyl 4-chloro-3-hydroxy-5-nitrobenzoate
CAS Number:
180031-12-3
Molecular Formula:
C8H6ClNO5
Molecular Weight:
231.5899
MDL Number:
MFCD28397262
IUPAC Name:
methyl 4-chloro-3-hydroxy-5-nitrobenzoate
InChI:
InChI=1S/C8H6ClNO5/c1-15-8(12)4-2-5(10(13)14)7(9)6(11)3-4/h2-3,11H,1H3
InChI Key:
UISBPFIZGNICMM-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(O)c(c(c1)[N+](=O)[O-])Cl
Properties
Complexity:
266  
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:
2  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties