7-methylbicyclo[2.2.1]heptane-2,7-diol

C8H14O2 — CID 130146915

IUPAC7-methylbicyclo[2.2.1]heptane-2,7-diol
SMILESCC1(O)C2CCC1C(O)C2
InChIInChI=1S/C8H14O2/c1-8(10)5-2-3-6(8)7(9)4-5/h5-7,9-10H,2-4H2,1H3
InChIKeyFGIVWKGBHIRTKE-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.53
Rot. Bonds

About 7-methylbicyclo[2.2.1]heptane-2,7-diol

7-methylbicyclo[2.2.1]heptane-2,7-diol (PubChem CID 130146915) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 7-methylbicyclo[2.2.1]heptane-2,7-diol.

Molecular Properties

Compound Name7-methylbicyclo[2.2.1]heptane-2,7-diol
PubChem CID130146915
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name7-methylbicyclo[2.2.1]heptane-2,7-diol
SMILESCC1(O)C2CCC1C(O)C2
InChIInChI=1S/C8H14O2/c1-8(10)5-2-3-6(8)7(9)4-5/h5-7,9-10H,2-4H2,1H3
InChIKeyFGIVWKGBHIRTKE-UHFFFAOYSA-N
XLogP0.53
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1R,2S,4S)-7,7-dimethylbicyclo[2.2.1]heptan-2-ol
CID 124541868
acetic acid;7,7-dimethylbicyclo[2.2.1]heptan-2-ol
CID 71385260
(1S,2S,4R,7S)-7-ethenylbicyclo[2.2.1]heptane-2,7-diol
CID 131201909
(1R,2R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-ol
CID 11263535
2-methylbicyclo[1.1.0]butan-2-ol
CID 123776938
(1S,2R,3R,7R,9R)-2,8-dimethyltricyclo[5.3.1.13,9]dodecane-2,8-diol
CID 102586581
5-methyl-2-(1-methylcyclopropyl)cyclohexan-1-ol
CID 130125033
bicyclo[2.2.2]octane-2,2,6-triol
CID 141006652
6,6-dimethoxybicyclo[2.2.2]octan-2-ol
CID 130145453
4,7,7-trimethylbicyclo[4.1.1]octan-3-ol
CID 90911661
(2S,3S,5S,8S,9S,10S,13R,14S,17S)-2-methoxy-10,13,17-trimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol;(2R,3S,5S,8S,9S,10S,13R,14S,17S)-2-methoxy-10,13,17-trimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
CID 160967610
(1R,2R,5R)-5-methyl-2-(2-methyl-1,3-dioxolan-2-yl)cyclohexan-1-ol
CID 162453236

Frequently Asked Questions

What is the IUPAC name of 7-methylbicyclo[2.2.1]heptane-2,7-diol?
The IUPAC name of 7-methylbicyclo[2.2.1]heptane-2,7-diol (CID 130146915) is 7-methylbicyclo[2.2.1]heptane-2,7-diol.
What is the SMILES notation for 7-methylbicyclo[2.2.1]heptane-2,7-diol?
The canonical SMILES for 7-methylbicyclo[2.2.1]heptane-2,7-diol is CC1(O)C2CCC1C(O)C2.
What is the InChIKey of 7-methylbicyclo[2.2.1]heptane-2,7-diol?
The InChIKey is FGIVWKGBHIRTKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-8(10)5-2-3-6(8)7(9)4-5/h5-7,9-10H,2-4H2,1H3.
What are the key properties of 7-methylbicyclo[2.2.1]heptane-2,7-diol?
7-methylbicyclo[2.2.1]heptane-2,7-diol has a molecular weight of 142.20 g/mol, XLogP of 0.53, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methylbicyclo[2.2.1]heptane-2,7-diol is sourced from PubChem (CID 130146915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).