Chemical ID: 4788162

c1ccc(c(c1)C(=O)c2cc(cc(c2)Cl)Cl)C(=O)O
Chemical ID:
4788162
Name [?]:
2-(3,5-dichlorobenzoyl)benzoic acid
SMILES [?]:
c1ccc(c(c1)C(=O)c2cc(cc(c2)Cl)Cl)C(=O)O
InChi [?]:
InChI=1/C14H8Cl2O3/c15-9-5-8(6-10(16)7-9)13(17)11-3-1-2-4-12(11)14(18)19/h1-7H,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,10,14,12,9,11,13,5,4,7,17,16,15,8,18,19/E:(5,6)(9,10)(15,16)(18,19)/rA:19nCCCCCCCOCCCCCCClClCOO/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;d10;s11;d12;d9s13;s13;s11;s4;d17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H8Cl2O3
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.96042
Area:461.771
Solvation:-2.58386
Coulombic:-37.9911
Bond Count [?]
All:20
Single:12
Double:8
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:295.117
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.43
LogP (Chemaxon):3.82

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