E0H

5-(3,4-dichlorophenyl)furan-2-carboxylic acid

Created:	2018-02-08
Last modified:	2019-08-21

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1 entries where E0H is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	0
Bond Count	23
Aromatic Bond Count	11

2D diagram of E0H

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Chemical Component Summary
Name	5-(3,4-dichlorophenyl)furan-2-carboxylic acid
Systematic Name (OpenEye OEToolkits)	5-(3,4-dichlorophenyl)furan-2-carboxylic acid
Formula	C₁₁ H₆ Cl₂ O₃
Molecular Weight	257.07
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	OC(=O)c1oc(cc1)c2ccc(Cl)c(Cl)c2
SMILES	OpenEye OEToolkits	2.0.6	c1cc(c(cc1c2ccc(o2)C(=O)O)Cl)Cl
Canonical SMILES	CACTVS	3.385	OC(=O)c1oc(cc1)c2ccc(Cl)c(Cl)c2
Canonical SMILES	OpenEye OEToolkits	2.0.6	c1cc(c(cc1c2ccc(o2)C(=O)O)Cl)Cl
InChI	InChI	1.03	InChI=1S/C11H6Cl2O3/c12-7-2-1-6(5-8(7)13)9-3-4-10(16-9)11(14)15/h1-5H,(H,14,15)
InChIKey	InChI	1.03	GNXLBNMHCYYSPU-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	736257
ChEMBL	CHEMBL4125811

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