PV4

2-phenoxy-5-propyl-phenol

Created:	2013-05-15
Last modified:	2014-09-05

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2 entries where PV4 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	33
Chiral Atom Count	0
Bond Count	34
Aromatic Bond Count	12

2D diagram of PV4

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Chemical Component Summary
Name	2-phenoxy-5-propyl-phenol
Systematic Name (OpenEye OEToolkits)	2-phenoxy-5-propyl-phenol
Formula	C₁₅ H₁₆ O₂
Molecular Weight	228.286
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O(c1ccccc1)c2ccc(cc2O)CCC
SMILES	CACTVS	3.385	CCCc1ccc(Oc2ccccc2)c(O)c1
SMILES	OpenEye OEToolkits	1.9.2	CCCc1ccc(c(c1)O)Oc2ccccc2
Canonical SMILES	CACTVS	3.385	CCCc1ccc(Oc2ccccc2)c(O)c1
Canonical SMILES	OpenEye OEToolkits	1.9.2	CCCc1ccc(c(c1)O)Oc2ccccc2
InChI	InChI	1.03	InChI=1S/C15H16O2/c1-2-6-12-9-10-15(14(16)11-12)17-13-7-4-3-5-8-13/h3-5,7-11,16H,2,6H2,1H3
InChIKey	InChI	1.03	JOZACDNAOCTHDN-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	16061417

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