Chemical ID: 6702432

c1cc(c(c(c1)Cl)S(=O)(=O)NCC(=O)[O-])Cl
Chemical ID:
6702432
Name [?]:
2-(2,6-dichlorophenyl)sulfonylaminoacetate
SMILES [?]:
c1cc(c(c(c1)Cl)S(=O)(=O)NCC(=O)[O-])Cl
InChi [?]:
InChI=1/C8H7Cl2NO4S/c9-5-2-1-3-6(10)8(5)16(14,15)11-4-7(12)13/h1-3,11H,4H2,(H,12,13)/p-1
InChi Info:
AuxInfo=1/1/N:1,2,6,12,3,5,13,4,16,7,11,14,15,9,10,8/E:(2,3)(5,6)(9,10)(12,13)(14,15)/CRV:16.6/rA:16nCCCCCCClSOONCCOO-Cl/rB:s1;d2;s3;d4;d1s5;s5;s4;d8;d8;s8;s11;s12;d13;s13;s3;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H6Cl2NO4S-
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:-32.8365
Area:408.77
Solvation:-43.0557
Coulombic:-13.9198
Bond Count [?]
All:16
Single:10
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:283.109
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.02
LogP (Chemaxon):1.5

Name Annotations

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Descriptor Annotations

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