Chemical ID: 7051724

CCN1c2c(cc(cc2Br)Br)C(=O)C1=O
Chemical ID:
7051724
Name [?]:
5,7-dibromo-1-ethyl-indoline-2,3-dione
SMILES [?]:
CCN1c2c(cc(cc2Br)Br)C(=O)C1=O
InChi [?]:
InChI=1/C10H7Br2NO2/c1-2-13-8-6(9(14)10(13)15)3-5(11)4-7(8)12/h3-4H,2H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,6,8,7,5,9,4,12,14,11,10,3,13,15/rA:15nCCNCCCCCCBrBrCOCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s7;s5;d12;s3s12;d14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H7Br2NO2
All Atoms:22
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.47086
Area:380.411
Solvation:-2.03942
Coulombic:-26.8915
Bond Count [?]
All:16
Single:11
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:332.976
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.75
LogP (Chemaxon):2.81

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Descriptor Annotations

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