2-cyclohex-2-en-1-ylethanol

C8H14O — CID 11116070

IUPAC2-cyclohex-2-en-1-ylethanol
SMILESOCCC1C=CCCC1
InChIInChI=1S/C8H14O/c9-7-6-8-4-2-1-3-5-8/h2,4,8-9H,1,3,5-7H2
InChIKeyNXKMMWGHYIZNSK-UHFFFAOYSA-N
MW126.20 g/mol
LogP1.73
Rot. Bonds2

About 2-cyclohex-2-en-1-ylethanol

2-cyclohex-2-en-1-ylethanol (PubChem CID 11116070) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is 2-cyclohex-2-en-1-ylethanol.

Molecular Properties

Compound Name2-cyclohex-2-en-1-ylethanol
PubChem CID11116070
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name2-cyclohex-2-en-1-ylethanol
SMILESOCCC1C=CCCC1
InChIInChI=1S/C8H14O/c9-7-6-8-4-2-1-3-5-8/h2,4,8-9H,1,3,5-7H2
InChIKeyNXKMMWGHYIZNSK-UHFFFAOYSA-N
XLogP1.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.73
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

Menthadienol
CID 527143
p-MENTH-1-EN-9-OL
CID 86753
3-Cyclohexene-1-methanol
CID 15512
Isocyclogeraniol
CID 109458
Bicyclo(2.2.1)hept-5-ene-2-methanol
CID 78946
Limonen-10-ol, (+)-
CID 11019061
Methylcyclohexenyl butanol
CID 85903
1-Cyclohexene-1-butanol, gamma-methyl-
CID 66584171
1-(Cyclohex-2-en-1-yl)ethan-1-ol
CID 86534
6-Ethyl-3-methyloct-6-en-1-ol
CID 117306
3-Cyclohexene-1-methanol, 6-methyl-
CID 110637
2-Cyclohexene-1-methanol
CID 11083859

Frequently Asked Questions

What is the IUPAC name of 2-cyclohex-2-en-1-ylethanol?
The IUPAC name of 2-cyclohex-2-en-1-ylethanol (CID 11116070) is 2-cyclohex-2-en-1-ylethanol.
What is the SMILES notation for 2-cyclohex-2-en-1-ylethanol?
The canonical SMILES for 2-cyclohex-2-en-1-ylethanol is OCCC1C=CCCC1.
What is the InChIKey of 2-cyclohex-2-en-1-ylethanol?
The InChIKey is NXKMMWGHYIZNSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c9-7-6-8-4-2-1-3-5-8/h2,4,8-9H,1,3,5-7H2.
What are the key properties of 2-cyclohex-2-en-1-ylethanol?
2-cyclohex-2-en-1-ylethanol has a molecular weight of 126.20 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohex-2-en-1-ylethanol is sourced from PubChem (CID 11116070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).