6-oxabicyclo[3.2.1]octan-1-ylmethanol

C8H14O2 — CID 15676003

IUPAC6-oxabicyclo[3.2.1]octan-1-ylmethanol
SMILESOCC12CCCC(C1)OC2
InChIInChI=1S/C8H14O2/c9-5-8-3-1-2-7(4-8)10-6-8/h7,9H,1-6H2
InChIKeyGMAMKSQOKSDKBV-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.94
Rot. Bonds1

About 6-oxabicyclo[3.2.1]octan-1-ylmethanol

6-oxabicyclo[3.2.1]octan-1-ylmethanol (PubChem CID 15676003) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 6-oxabicyclo[3.2.1]octan-1-ylmethanol.

Molecular Properties

Compound Name6-oxabicyclo[3.2.1]octan-1-ylmethanol
PubChem CID15676003
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name6-oxabicyclo[3.2.1]octan-1-ylmethanol
SMILESOCC12CCCC(C1)OC2
InChIInChI=1S/C8H14O2/c9-5-8-3-1-2-7(4-8)10-6-8/h7,9H,1-6H2
InChIKeyGMAMKSQOKSDKBV-UHFFFAOYSA-N
XLogP0.94
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-oxabicyclo[3.2.1]octan-1-ylmethanamine
CID 138040688
2-oxabicyclo[2.2.2]octan-4-ylmethanol
CID 135392871
2-(2-oxabicyclo[2.2.2]octan-4-yl)acetic acid
CID 146152422
1-(hydroxymethyl)-6-oxa-3-azabicyclo[3.2.1]octane-3-carboxylic acid
CID 118384399
(4S,6S)-4-(hydroxymethyl)-2-oxabicyclo[2.2.1]heptan-6-ol
CID 134970585
[(3S,6S)-1-tricyclo[4.3.1.13,8]undecanyl]methanol
CID 6974562
[(1R,9S,12S,14R)-9-methyl-8,15-dioxatetracyclo[10.2.2.02,7.09,14]hexadeca-2,4,6-trien-12-yl]methanol
CID 929018
(1-cyclobutyl-2,6,7-trioxabicyclo[2.2.2]octan-4-yl)methanol
CID 59792382
(3-methyl-2,3,4,5,6,6a-hexahydrocyclopenta[b]furan-3a-yl)methanol
CID 130151002
1-adamantylmethanol;hydrochloride
CID 141053946
1-(hydroxymethyl)bicyclo[4.1.1]octan-3-ol
CID 123204743
[1-(1,3-dioxolan-2-yl)cyclopentyl]methanol
CID 15324211

Frequently Asked Questions

What is the IUPAC name of 6-oxabicyclo[3.2.1]octan-1-ylmethanol?
The IUPAC name of 6-oxabicyclo[3.2.1]octan-1-ylmethanol (CID 15676003) is 6-oxabicyclo[3.2.1]octan-1-ylmethanol.
What is the SMILES notation for 6-oxabicyclo[3.2.1]octan-1-ylmethanol?
The canonical SMILES for 6-oxabicyclo[3.2.1]octan-1-ylmethanol is OCC12CCCC(C1)OC2.
What is the InChIKey of 6-oxabicyclo[3.2.1]octan-1-ylmethanol?
The InChIKey is GMAMKSQOKSDKBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c9-5-8-3-1-2-7(4-8)10-6-8/h7,9H,1-6H2.
What are the key properties of 6-oxabicyclo[3.2.1]octan-1-ylmethanol?
6-oxabicyclo[3.2.1]octan-1-ylmethanol has a molecular weight of 142.20 g/mol, XLogP of 0.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxabicyclo[3.2.1]octan-1-ylmethanol is sourced from PubChem (CID 15676003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).