(1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol

C8H14O2 — CID 102418243

IUPAC(1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol
SMILESC=C1CCCC[C@]1(O)CO
InChIInChI=1S/C8H14O2/c1-7-4-2-3-5-8(7,10)6-9/h9-10H,1-6H2/t8-/m0/s1
InChIKeyHEZFBPXICREZAA-QMMMGPOBSA-N
MW142.20 g/mol
LogP0.84
Rot. Bonds1

About (1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol

(1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol (PubChem CID 102418243) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is (1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol.

Molecular Properties

Compound Name(1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol
PubChem CID102418243
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name(1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol
SMILESC=C1CCCC[C@]1(O)CO
InChIInChI=1S/C8H14O2/c1-7-4-2-3-5-8(7,10)6-9/h9-10H,1-6H2/t8-/m0/s1
InChIKeyHEZFBPXICREZAA-QMMMGPOBSA-N
XLogP0.84
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol?
The IUPAC name of (1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol (CID 102418243) is (1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol.
What is the SMILES notation for (1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol?
The canonical SMILES for (1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol is C=C1CCCC[C@]1(O)CO.
What is the InChIKey of (1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol?
The InChIKey is HEZFBPXICREZAA-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H14O2/c1-7-4-2-3-5-8(7,10)6-9/h9-10H,1-6H2/t8-/m0/s1.
What are the key properties of (1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol?
(1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol has a molecular weight of 142.20 g/mol, XLogP of 0.84, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(hydroxymethyl)-2-methylidenecyclohexan-1-ol is sourced from PubChem (CID 102418243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).