1,2-dicyclohexyloxybenzene

C18H26O2 — CID 67331328

IUPAC1,2-dicyclohexyloxybenzene
SMILESc1ccc(OC2CCCCC2)c(OC2CCCCC2)c1
InChIInChI=1S/C18H26O2/c1-3-9-15(10-4-1)19-17-13-7-8-14-18(17)20-16-11-5-2-6-12-16/h7-8,13-16H,1-6,9-12H2
InChIKeyYWBDMYUZGIIBJY-UHFFFAOYSA-N
MW274.40 g/mol
LogP5.11
Rot. Bonds4

About 1,2-dicyclohexyloxybenzene

1,2-dicyclohexyloxybenzene (PubChem CID 67331328) has the molecular formula C18H26O2 and a molecular weight of 274.40 g/mol. Its IUPAC name is 1,2-dicyclohexyloxybenzene.

Molecular Properties

Compound Name1,2-dicyclohexyloxybenzene
PubChem CID67331328
Molecular FormulaC18H26O2
Molecular Weight274.40 g/mol
Exact Mass274.19
IUPAC Name1,2-dicyclohexyloxybenzene
SMILESc1ccc(OC2CCCCC2)c(OC2CCCCC2)c1
InChIInChI=1S/C18H26O2/c1-3-9-15(10-4-1)19-17-13-7-8-14-18(17)20-16-11-5-2-6-12-16/h7-8,13-16H,1-6,9-12H2
InChIKeyYWBDMYUZGIIBJY-UHFFFAOYSA-N
XLogP5.11
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.40
LogP ≤ 55.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2-dicyclohexyloxybenzene?
The IUPAC name of 1,2-dicyclohexyloxybenzene (CID 67331328) is 1,2-dicyclohexyloxybenzene.
What is the SMILES notation for 1,2-dicyclohexyloxybenzene?
The canonical SMILES for 1,2-dicyclohexyloxybenzene is c1ccc(OC2CCCCC2)c(OC2CCCCC2)c1.
What is the InChIKey of 1,2-dicyclohexyloxybenzene?
The InChIKey is YWBDMYUZGIIBJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26O2/c1-3-9-15(10-4-1)19-17-13-7-8-14-18(17)20-16-11-5-2-6-12-16/h7-8,13-16H,1-6,9-12H2.
What are the key properties of 1,2-dicyclohexyloxybenzene?
1,2-dicyclohexyloxybenzene has a molecular weight of 274.40 g/mol, XLogP of 5.11, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dicyclohexyloxybenzene is sourced from PubChem (CID 67331328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).