RCF

(2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoic acid

Created:	2019-06-03
Last modified:	2019-06-12

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1 entries where RCF is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	34
Chiral Atom Count	1
Bond Count	35
Aromatic Bond Count	12

2D diagram of RCF

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Chemical Component Summary
Name	(2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoic acid
Systematic Name (OpenEye OEToolkits)	(2~{R})-2-[4-(4-cyano-2-fluoranyl-phenoxy)phenoxy]propanoic acid
Formula	C₁₆ H₁₂ F N O₄
Molecular Weight	301.269
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	N#Cc1ccc(c(c1)F)Oc2ccc(OC(C)C(O)=O)cc2
SMILES	CACTVS	3.385	C[CH](Oc1ccc(Oc2ccc(cc2F)C#N)cc1)C(O)=O
SMILES	OpenEye OEToolkits	2.0.7	CC(C(=O)O)Oc1ccc(cc1)Oc2ccc(cc2F)C#N
Canonical SMILES	CACTVS	3.385	C[C@@H](Oc1ccc(Oc2ccc(cc2F)C#N)cc1)C(O)=O
Canonical SMILES	OpenEye OEToolkits	2.0.7	C[C@H](C(=O)O)Oc1ccc(cc1)Oc2ccc(cc2F)C#N
InChI	InChI	1.03	InChI=1S/C16H12FNO4/c1-10(16(19)20)21-12-3-5-13(6-4-12)22-15-7-2-11(9-18)8-14(15)17/h2-8,10H,1H3,(H,19,20)/t10-/m1/s1
InChIKey	InChI	1.03	ROBSGBGTWRRYSK-SNVBAGLBSA-N

Related Resource References

Resource Name	Reference
PubChem	15118048

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