General Information of the Compound
| Compound ID |
CP0696842
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| Compound Name |
(E)-2-chloro-3'-fluoro-4,4'-dihydroxybiphenyl-3-carbaldehyde oxime
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| Structure |
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| Formula |
C13H9ClFNO3
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| Molecular Weight |
281.67
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| Canonical SMILES |
O/N=C/c1c(O)ccc(-c2ccc(O)c(F)c2)c1Cl
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| InChI |
InChI=1S/C13H9ClFNO3/c14-13-8(2-4-11(17)9(13)6-16-19)7-1-3-12(18)10(15)5-7/h1-6,17-19H/b16-6+
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| InChIKey |
CWBFECUIDZXHBY-OMCISZLKSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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