[(2R)-butan-2-yl]oxycyclohexane

C10H20O — CID 59954447

IUPAC[(2R)-butan-2-yl]oxycyclohexane
SMILESCC[C@@H](C)OC1CCCCC1
InChIInChI=1S/C10H20O/c1-3-9(2)11-10-7-5-4-6-8-10/h9-10H,3-8H2,1-2H3/t9-/m1/s1
InChIKeyLIOFBZRFPYYIEN-SECBINFHSA-N
MW156.27 g/mol
LogP3.13
Rot. Bonds3

About [(2R)-butan-2-yl]oxycyclohexane

[(2R)-butan-2-yl]oxycyclohexane (PubChem CID 59954447) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is [(2R)-butan-2-yl]oxycyclohexane.

Molecular Properties

Compound Name[(2R)-butan-2-yl]oxycyclohexane
PubChem CID59954447
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name[(2R)-butan-2-yl]oxycyclohexane
SMILESCC[C@@H](C)OC1CCCCC1
InChIInChI=1S/C10H20O/c1-3-9(2)11-10-7-5-4-6-8-10/h9-10H,3-8H2,1-2H3/t9-/m1/s1
InChIKeyLIOFBZRFPYYIEN-SECBINFHSA-N
XLogP3.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [(2R)-butan-2-yl]oxycyclohexane?
The IUPAC name of [(2R)-butan-2-yl]oxycyclohexane (CID 59954447) is [(2R)-butan-2-yl]oxycyclohexane.
What is the SMILES notation for [(2R)-butan-2-yl]oxycyclohexane?
The canonical SMILES for [(2R)-butan-2-yl]oxycyclohexane is CC[C@@H](C)OC1CCCCC1.
What is the InChIKey of [(2R)-butan-2-yl]oxycyclohexane?
The InChIKey is LIOFBZRFPYYIEN-SECBINFHSA-N. The full InChI is InChI=1S/C10H20O/c1-3-9(2)11-10-7-5-4-6-8-10/h9-10H,3-8H2,1-2H3/t9-/m1/s1.
What are the key properties of [(2R)-butan-2-yl]oxycyclohexane?
[(2R)-butan-2-yl]oxycyclohexane has a molecular weight of 156.27 g/mol, XLogP of 3.13, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-butan-2-yl]oxycyclohexane is sourced from PubChem (CID 59954447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).