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AHAS inhibitor

CAS No.:
219793-45-0
Catalog Number:
AG00BF21
Molecular Formula:
C19H12ClNO6S
Molecular Weight:
417.8197
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
96%
1 week
United States
$140
- +
10mg
96%
1 week
United States
$182
- +
25mg
≥98%
1 week
United States
$283
- +
50mg
96%
1 week
United States
$286
- +
100mg
96%
1 week
United States
$446
- +
Product Description
Catalog Number:
AG00BF21
Chemical Name:
AHAS inhibitor
CAS Number:
219793-45-0
Molecular Formula:
C19H12ClNO6S
Molecular Weight:
417.8197
MDL Number:
MFCD00103060
IUPAC Name:
[5-(benzenesulfonyl)-2-nitrophenyl] 4-chlorobenzoate
InChI:
InChI=1S/C19H12ClNO6S/c20-14-8-6-13(7-9-14)19(22)27-18-12-16(10-11-17(18)21(23)24)28(25,26)15-4-2-1-3-5-15/h1-12H
InChI Key:
WNDWKKPBLAKXMI-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C(=O)Oc1cc(ccc1[N+](=O)[O-])S(=O)(=O)c1ccccc1
Properties
Complexity:
659  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
417.007g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
417.816g/mol
Monoisotopic Mass:
417.007g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties