HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

4-(2,6-Dinitro-4-(trifluoromethyl)phenoxy)benzenesulfonoyl chloride

HCID 178809889
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
338962-07-5
Standard SMILES
O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1Oc1ccc(S(=O)(=O)Cl)cc1
InChIKey
KPUBNFODPLTKIC-UHFFFAOYSA-N
Molecular formula
C13H6ClF3N2O7S
Average molar mass
426.71 g/mol

Names & identifiers

Preferred name
4-(2,6-Dinitro-4-(trifluoromethyl)phenoxy)benzenesulfonoyl chloride
IUPAC
4-[2,6-dinitro-4-(trifluoromethyl)phenoxy]benzenesulfonyl chloride
English name
4-[2,6-Dinitro-4-(trifluoromethyl)phenoxy]benzenesulfonoyl chloride
Molecular formula
C13H6ClF3N2O7S
Molecular weight
426.71

Names & synonyms

338962-07-54-(2,6-Dinitro-4-(trifluoromethyl)phenoxy)benzenesulfonoyl chloride4-[2,6-dinitro-4-(trifluoromethyl)phenoxy]benzenesulfonyl Chloride4-[2,6-dinitro-4-(trifluoromethyl)phenoxy]benzene-1-sulfonyl chlorideAKOS0050956035M-0094-[2,6-dinitro-4-(trifluoromethyl)phenoxy]benzene-1-sulfonylchloride4-[2,6-Dinitro-4-(trifluoromethyl)phenoxy]benzenesulfonoyl chlorideBenzenesulfonyl chloride, 4-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-

Database identifiers

CAS
338962-07-5

Properties

Computed structural propertiesFilling in

XLogP
4
Topological polar surface area
143 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
10
Rotatable bonds
3
Heavy atoms
27
Formal charge
0
Complexity
641

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes