Chemical ID: 4532285

c12c(c(c(c(c1Cl)Cl)Cl)Cl)C(=O)NC2=O
Chemical ID:
4532285
Name [?]:
4,5,6,7-tetrachloroisoindoline-1,3-dione
SMILES [?]:
c12c(c(c(c(c1Cl)Cl)Cl)Cl)C(=O)NC2=O
InChi [?]:
InChI=1/C8HCl4NO2/c9-3-1-2(8(15)13-7(1)14)4(10)6(12)5(3)11/h(H,13,14,15)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,4,14,11,7,10,8,9,13,15,12/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(14,15)/rA:15nCCCCCCClClClClCONCO/rB:s1;d2;s3;d4;d1s5;s6;s5;s4;s3;s2;d11;s11;s1s13;d14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8HCl4NO2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:6.74845
Area:393.015
Solvation:-3.07693
Coulombic:-27.2254
Bond Count [?]
All:16
Single:11
Double:5
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:284.91
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.48
LogP (Chemaxon):2.45

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