Chemical ID: 7432564

CC(=O)N1c2cc(cc(c2C(=O)C1=O)Cl)Cl
Chemical ID:
7432564
Name [?]:
1-acetyl-4,6-dichloro-indoline-2,3-dione
SMILES [?]:
CC(=O)N1c2cc(cc(c2C(=O)C1=O)Cl)Cl
InChi [?]:
InChI=1/C10H5Cl2NO3/c1-4(14)13-7-3-5(11)2-6(12)8(7)9(15)10(13)16/h2-3H,1H3
InChi Info:
AuxInfo=1/0/N:1,8,6,2,7,9,5,10,11,13,16,15,4,3,12,14/rA:16nCCONCCCCCCCOCOClCl/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s10;d11;s4s11;d13;s9;s7;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H5Cl2NO3
All Atoms:21
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.13331
Area:395.489
Solvation:-2.75392
Coulombic:-33.6215
Bond Count [?]
All:17
Single:11
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:258.057
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:1.84
LogP (Chemaxon):1.67

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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