Chemical ID: 4259146

c1(=O)n(c(=O)n(c(=O)n1Cl)Cl)Cl
Chemical ID:
4259146
Name [?]:
1,3,5-trichloro-1,3,5-triazinane-2,4,6-trione
SMILES [?]:
c1(=O)n(c(=O)n(c(=O)n1Cl)Cl)Cl
InChi [?]:
InChI=1/C3Cl3N3O3/c4-7-1(10)8(5)3(12)9(6)2(7)11
InChi Info:
AuxInfo=1/0/N:1,4,7,12,10,11,3,9,6,2,5,8/E:(1,2,3)(4,5,6)(7,8,9)(10,11,12)/rA:12nCONCONCONClClCl/rB:d1;s1;s3;d4;s4;s6;d7;s1s7;s9;s6;s3;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C3Cl3N3O3
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.65579
Area:341.256
Solvation:-1.8756
Coulombic:-45.2645
Bond Count [?]
All:12
Single:9
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:232.409
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.59
LogP (Chemaxon):0.96

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Descriptor Annotations

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