8-hydroxycyclooct-2-en-1-one

C8H12O2 — CID 57012660

IUPAC8-hydroxycyclooct-2-en-1-one
SMILESO=C1C=CCCCCC1O
InChIInChI=1S/C8H12O2/c9-7-5-3-1-2-4-6-8(7)10/h3,5,8,10H,1-2,4,6H2
InChIKeyWLPROBICUJKLRL-UHFFFAOYSA-N
MW140.18 g/mol
LogP1.05
Rot. Bonds

About 8-hydroxycyclooct-2-en-1-one

8-hydroxycyclooct-2-en-1-one (PubChem CID 57012660) has the molecular formula C8H12O2 and a molecular weight of 140.18 g/mol. Its IUPAC name is 8-hydroxycyclooct-2-en-1-one.

Molecular Properties

Compound Name8-hydroxycyclooct-2-en-1-one
PubChem CID57012660
Molecular FormulaC8H12O2
Molecular Weight140.18 g/mol
Exact Mass140.08
IUPAC Name8-hydroxycyclooct-2-en-1-one
SMILESO=C1C=CCCCCC1O
InChIInChI=1S/C8H12O2/c9-7-5-3-1-2-4-6-8(7)10/h3,5,8,10H,1-2,4,6H2
InChIKeyWLPROBICUJKLRL-UHFFFAOYSA-N
XLogP1.05
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.18
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-1-(cyclohexen-1-yl)-2-hydroxypropan-1-one
CID 9793876
(4Z)-8-hydroxy-cyclooct-4-en-1-one
CID 5381495
1-(1-Cyclohexenyl)-2-hydroxyethanone
CID 12431602
1-(Cyclohexen-1-yl)-2-hydroxypropan-1-one
CID 85039917
(2Z,4S)-4-hydroxycyclooct-2-en-1-one
CID 11976994
(2Z,4R)-4-hydroxycyclooct-2-en-1-one
CID 101414098
(z)-Oxycyclotridec-10-en-2-one
CID 129776549
7-Hydroxycyclohept-2-en-1-one
CID 14945504
(2R)-1-(cyclohexen-1-yl)-2-hydroxypropan-1-one
CID 101850940
2-Hydroxy-5-cycloocten-1-one
CID 273705
(9Z)-2-hydroxycycloheptadec-9-en-1-one
CID 9900034
2-(8-Hydroxy-7-oxo-octyl)cyclopent-2-en-1-one
CID 20287628

Frequently Asked Questions

What is the IUPAC name of 8-hydroxycyclooct-2-en-1-one?
The IUPAC name of 8-hydroxycyclooct-2-en-1-one (CID 57012660) is 8-hydroxycyclooct-2-en-1-one.
What is the SMILES notation for 8-hydroxycyclooct-2-en-1-one?
The canonical SMILES for 8-hydroxycyclooct-2-en-1-one is O=C1C=CCCCCC1O.
What is the InChIKey of 8-hydroxycyclooct-2-en-1-one?
The InChIKey is WLPROBICUJKLRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O2/c9-7-5-3-1-2-4-6-8(7)10/h3,5,8,10H,1-2,4,6H2.
What are the key properties of 8-hydroxycyclooct-2-en-1-one?
8-hydroxycyclooct-2-en-1-one has a molecular weight of 140.18 g/mol, XLogP of 1.05, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxycyclooct-2-en-1-one is sourced from PubChem (CID 57012660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).