(2R,4S)-4-cyclohexyl-2-ethoxyoxolane

C12H22O2 — CID 10821828

IUPAC(2R,4S)-4-cyclohexyl-2-ethoxyoxolane
SMILESCCO[C@H]1C[C@@H](C2CCCCC2)CO1
InChIInChI=1S/C12H22O2/c1-2-13-12-8-11(9-14-12)10-6-4-3-5-7-10/h10-12H,2-9H2,1H3/t11-,12-/m1/s1
InChIKeyGZYUQHOQXJFMEU-VXGBXAGGSA-N
MW198.31 g/mol
LogP2.97
Rot. Bonds3

About (2R,4S)-4-cyclohexyl-2-ethoxyoxolane

(2R,4S)-4-cyclohexyl-2-ethoxyoxolane (PubChem CID 10821828) has the molecular formula C12H22O2 and a molecular weight of 198.31 g/mol. Its IUPAC name is (2R,4S)-4-cyclohexyl-2-ethoxyoxolane.

Molecular Properties

Compound Name(2R,4S)-4-cyclohexyl-2-ethoxyoxolane
PubChem CID10821828
Molecular FormulaC12H22O2
Molecular Weight198.31 g/mol
Exact Mass198.16
IUPAC Name(2R,4S)-4-cyclohexyl-2-ethoxyoxolane
SMILESCCO[C@H]1C[C@@H](C2CCCCC2)CO1
InChIInChI=1S/C12H22O2/c1-2-13-12-8-11(9-14-12)10-6-4-3-5-7-10/h10-12H,2-9H2,1H3/t11-,12-/m1/s1
InChIKeyGZYUQHOQXJFMEU-VXGBXAGGSA-N
XLogP2.97
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,4R)-2-ethoxy-4-methyloxolane
CID 102317683
(2R,4S)-2-ethoxy-4-methyloxolane
CID 10558657
(2S,4R,5S)-2-ethoxy-5-(hydroxymethyl)oxan-4-ol
CID 129321316
magnesium;2-ethoxyoxane;dichloride
CID 158421621
ethoxycyclooctane
CID 13427982
[(2R,4S)-4-cyclopentyloxolan-2-yl]methanamine
CID 125456482
azane;ethoxycyclooctane
CID 70271275
trans-(1R,2R)-1,2-diethoxycyclohexane
CID 13170081
cyclononylcycloicosane
CID 123187062
2-ethoxy-1-oxaspiro[4.4]nonane
CID 549196
cyclohexylcycloheptane
CID 524589
(4aR)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene
CID 58427678

Frequently Asked Questions

What is the IUPAC name of (2R,4S)-4-cyclohexyl-2-ethoxyoxolane?
The IUPAC name of (2R,4S)-4-cyclohexyl-2-ethoxyoxolane (CID 10821828) is (2R,4S)-4-cyclohexyl-2-ethoxyoxolane.
What is the SMILES notation for (2R,4S)-4-cyclohexyl-2-ethoxyoxolane?
The canonical SMILES for (2R,4S)-4-cyclohexyl-2-ethoxyoxolane is CCO[C@H]1C[C@@H](C2CCCCC2)CO1.
What is the InChIKey of (2R,4S)-4-cyclohexyl-2-ethoxyoxolane?
The InChIKey is GZYUQHOQXJFMEU-VXGBXAGGSA-N. The full InChI is InChI=1S/C12H22O2/c1-2-13-12-8-11(9-14-12)10-6-4-3-5-7-10/h10-12H,2-9H2,1H3/t11-,12-/m1/s1.
What are the key properties of (2R,4S)-4-cyclohexyl-2-ethoxyoxolane?
(2R,4S)-4-cyclohexyl-2-ethoxyoxolane has a molecular weight of 198.31 g/mol, XLogP of 2.97, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4S)-4-cyclohexyl-2-ethoxyoxolane is sourced from PubChem (CID 10821828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).