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

C7H12O — CID 13012384

IUPAC(1R)-2-methylidenecyclohexan-1-ol
SMILESC=C1CCCC[C@H]1O
InChIInChI=1S/C7H12O/c1-6-4-2-3-5-7(6)8/h7-8H,1-5H2/t7-/m1/s1
InChIKeyGTAPKXQXCYRLRG-SSDOTTSWSA-N
MW112.17 g/mol
LogP1.48
Rot. Bonds

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

(1R)-2-methylidenecyclohexan-1-ol (PubChem CID 13012384) has the molecular formula C7H12O and a molecular weight of 112.17 g/mol. Its IUPAC name is (1R)-2-methylidenecyclohexan-1-ol.

Molecular Properties

Compound Name(1R)-2-methylidenecyclohexan-1-ol
PubChem CID13012384
Molecular FormulaC7H12O
Molecular Weight112.17 g/mol
Exact Mass112.09
IUPAC Name(1R)-2-methylidenecyclohexan-1-ol
SMILESC=C1CCCC[C@H]1O
InChIInChI=1S/C7H12O/c1-6-4-2-3-5-7(6)8/h7-8H,1-5H2/t7-/m1/s1
InChIKeyGTAPKXQXCYRLRG-SSDOTTSWSA-N
XLogP1.48
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.17
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-Methylidenecyclohexan-1-ol
CID 317435
4-Methylidenecyclohexan-1-ol
CID 13808288
3-Methylidenecyclohexane-1,2-diol
CID 70670041
2-Methylidenehexan-1-ol
CID 11366970
2-(Difluoromethylidene)cyclohexan-1-ol
CID 13551201
3-Methylenecyclohexanol
CID 13244819
2-(1-Hexenylidene)cyclohexanol
CID 13775734
4-Methylidenehexan-3-ol
CID 14590217
4-Fluoro-2-methylidenecyclohexan-1-ol
CID 90955637
3-Fluoro-2-methylidenecyclohexan-1-ol
CID 91024461
2,6-Difluoro-4-methylidenecyclohexan-1-ol
CID 91076601
5-Fluoro-2-methylidenecyclohexan-1-ol
CID 91122215

Frequently Asked Questions

What is the IUPAC name of (1R)-2-methylidenecyclohexan-1-ol?
The IUPAC name of (1R)-2-methylidenecyclohexan-1-ol (CID 13012384) is (1R)-2-methylidenecyclohexan-1-ol.
What is the SMILES notation for (1R)-2-methylidenecyclohexan-1-ol?
The canonical SMILES for (1R)-2-methylidenecyclohexan-1-ol is C=C1CCCC[C@H]1O.
What is the InChIKey of (1R)-2-methylidenecyclohexan-1-ol?
The InChIKey is GTAPKXQXCYRLRG-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H12O/c1-6-4-2-3-5-7(6)8/h7-8H,1-5H2/t7-/m1/s1.
What are the key properties of (1R)-2-methylidenecyclohexan-1-ol?
(1R)-2-methylidenecyclohexan-1-ol has a molecular weight of 112.17 g/mol, XLogP of 1.48, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-methylidenecyclohexan-1-ol is sourced from PubChem (CID 13012384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).