cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol

C8H16O2 — CID 71357650

IUPACcis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol
SMILESOCC[C@@H]1CCCC[C@H]1O
InChIInChI=1S/C8H16O2/c9-6-5-7-3-1-2-4-8(7)10/h7-10H,1-6H2/t7-,8+/m0/s1
InChIKeyKELMAQQLJLWUAY-JGVFFNPUSA-N
MW144.21 g/mol
LogP0.92
Rot. Bonds2

About cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol

cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol (PubChem CID 71357650) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol.

Molecular Properties

Compound Namecis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol
PubChem CID71357650
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Namecis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol
SMILESOCC[C@@H]1CCCC[C@H]1O
InChIInChI=1S/C8H16O2/c9-6-5-7-3-1-2-4-8(7)10/h7-10H,1-6H2/t7-,8+/m0/s1
InChIKeyKELMAQQLJLWUAY-JGVFFNPUSA-N
XLogP0.92
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-2-propylcyclohexan-1-ol
CID 144627240
(1S,2S,3S)-3-(hydroxymethyl)cyclohexane-1,2-diol
CID 161165150
2-(2-methoxyethyl)cyclohexan-1-ol
CID 14682106
2-[(1S,2S)-2-(trifluoromethyl)cyclohexyl]ethanol
CID 11138028
trans-(1R,2S)-2-hexylcyclopentan-1-ol
CID 10797255
cis-(1S,2S)-2-hexylcyclopentan-1-ol
CID 10654739
2-pent-4-enylcyclohexan-1-ol
CID 59087603
2-pent-3-ynylcyclohexan-1-ol
CID 104810024
ethane;2-ethylcyclopentan-1-ol
CID 144624771
trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride
CID 134691166
2-[2-(3-azabicyclo[3.3.1]nonan-3-yl)ethyl]cyclopentan-1-ol
CID 114196744
2-(2-propoxyethyl)cyclopentan-1-ol
CID 79564356

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol?
The IUPAC name of cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol (CID 71357650) is cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol.
What is the SMILES notation for cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol?
The canonical SMILES for cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol is OCC[C@@H]1CCCC[C@H]1O.
What is the InChIKey of cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol?
The InChIKey is KELMAQQLJLWUAY-JGVFFNPUSA-N. The full InChI is InChI=1S/C8H16O2/c9-6-5-7-3-1-2-4-8(7)10/h7-10H,1-6H2/t7-,8+/m0/s1.
What are the key properties of cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol?
cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol has a molecular weight of 144.21 g/mol, XLogP of 0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol is sourced from PubChem (CID 71357650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).