cyclohexa-1,5-dien-1-ol;ethane

C8H14O — CID 143526477

IUPACcyclohexa-1,5-dien-1-ol;ethane
SMILESCC.OC1=CCCC=C1
InChIInChI=1S/C6H8O.C2H6/c7-6-4-2-1-3-5-6;1-2/h2,4-5,7H,1,3H2;1-2H3
InChIKeyOSEMCJSNXBCDNO-UHFFFAOYSA-N
MW126.20 g/mol
LogP2.80
Rot. Bonds

About cyclohexa-1,5-dien-1-ol;ethane

cyclohexa-1,5-dien-1-ol;ethane (PubChem CID 143526477) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is cyclohexa-1,5-dien-1-ol;ethane.

Molecular Properties

Compound Namecyclohexa-1,5-dien-1-ol;ethane
PubChem CID143526477
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Namecyclohexa-1,5-dien-1-ol;ethane
SMILESCC.OC1=CCCC=C1
InChIInChI=1S/C6H8O.C2H6/c7-6-4-2-1-3-5-6;1-2/h2,4-5,7H,1,3H2;1-2H3
InChIKeyOSEMCJSNXBCDNO-UHFFFAOYSA-N
XLogP2.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

CID 159185044
CID 159185044
di(cyclohexa-1,5-dien-1-yl)methanone;ethane
CID 144664025
ethane;2-methylcyclohexa-1,3-diene;propane
CID 144716952
methane;2-methylcyclohexa-1,3-diene
CID 143188946
methanol;2-methylcyclohexa-1,3-diene;propane
CID 142947667
(1R)-1-cyclohexa-1,5-dien-1-ylethanol
CID 101132775
1,1-di(cyclohexa-1,5-dien-1-yl)ethanol
CID 171099353
2-cyclohexa-1,5-dien-1-ylcyclopropen-1-ol
CID 89328023
(1E,4Z)-5-methylcycloocta-1,4,7-trien-1-ol
CID 143207326
3-(cyclohexa-1,5-dien-1-ylmethyl)pentan-2-one;ethane
CID 178167995
methanol;2-(3-methylbuta-1,3-dien-2-yl)cyclohexa-1,3-diene
CID 164543952
cyclohexa-1,5-diene-1-thiol
CID 20674922

Frequently Asked Questions

What is the IUPAC name of cyclohexa-1,5-dien-1-ol;ethane?
The IUPAC name of cyclohexa-1,5-dien-1-ol;ethane (CID 143526477) is cyclohexa-1,5-dien-1-ol;ethane.
What is the SMILES notation for cyclohexa-1,5-dien-1-ol;ethane?
The canonical SMILES for cyclohexa-1,5-dien-1-ol;ethane is CC.OC1=CCCC=C1.
What is the InChIKey of cyclohexa-1,5-dien-1-ol;ethane?
The InChIKey is OSEMCJSNXBCDNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O.C2H6/c7-6-4-2-1-3-5-6;1-2/h2,4-5,7H,1,3H2;1-2H3.
What are the key properties of cyclohexa-1,5-dien-1-ol;ethane?
cyclohexa-1,5-dien-1-ol;ethane has a molecular weight of 126.20 g/mol, XLogP of 2.80, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexa-1,5-dien-1-ol;ethane is sourced from PubChem (CID 143526477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).