Chemical ID: 5183828

c1cc(c(c(c1)Br)C(=O)O)Cl
Chemical ID:
5183828
Name [?]:
2-bromo-6-chloro-benzoic acid
SMILES [?]:
c1cc(c(c(c1)Br)C(=O)O)Cl
InChi [?]:
InChI=1/C7H4BrClO2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H,10,11)
InChi Info:
AuxInfo=1/1/N:1,6,2,5,3,4,8,7,11,9,10/E:(10,11)/rA:11nCCCCCCBrCOOCl/rB:s1;d2;s3;d4;d1s5;s5;s4;d8;s8;s3;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H4BrClO2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.58497
Area:323.119
Solvation:-1.49299
Coulombic:-28.2417
Bond Count [?]
All:11
Single:7
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:235.462
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.06
LogP (Chemaxon):2.87

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Descriptor Annotations

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