Chemical ID: 6509055

c1cc(c(cc1Cl)Cl)N2C(=O)CCC2=O
Chemical ID:
6509055
Name [?]:
1-(2,4-dichlorophenyl)pyrrolidine-2,5-dione
SMILES [?]:
c1cc(c(cc1Cl)Cl)N2C(=O)CCC2=O
InChi [?]:
InChI=1/C10H7Cl2NO2/c11-6-1-2-8(7(12)5-6)13-9(14)3-4-10(13)15/h1-2,5H,3-4H2
InChi Info:
AuxInfo=1/0/N:1,2,12,13,5,6,4,3,10,14,7,8,9,11,15/E:(3,4)(9,10)(14,15)/rA:15nCCCCCCClClNCOCCCO/rB:s1;d2;s3;d4;d1s5;s6;s4;s3;s9;d10;s10;s12;s9s13;d14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H7Cl2NO2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:6.82588
Area:391.302
Solvation:-2.95667
Coulombic:-22.9325
Bond Count [?]
All:16
Single:11
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:244.074
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.98
LogP (Chemaxon):1.89

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Descriptor Annotations

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