1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol

C10H16O — CID 90828048

IUPAC1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol
SMILESCC1=CC(C)C(C(C)O)C=C1
InChIInChI=1S/C10H16O/c1-7-4-5-10(9(3)11)8(2)6-7/h4-6,8-11H,1-3H3
InChIKeyNLBQBYFAUZEOJP-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.14
Rot. Bonds1

About 1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol

1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol (PubChem CID 90828048) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol.

Molecular Properties

Compound Name1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol
PubChem CID90828048
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol
SMILESCC1=CC(C)C(C(C)O)C=C1
InChIInChI=1S/C10H16O/c1-7-4-5-10(9(3)11)8(2)6-7/h4-6,8-11H,1-3H3
InChIKeyNLBQBYFAUZEOJP-UHFFFAOYSA-N
XLogP2.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-(3-ethylidene-4-prop-1-en-2-ylhex-4-en-2-yl)-2,6-dimethylcyclohexa-1,3-diene
CID 123390260
[(2S,3R)-3-[(6S)-4,6-dimethylcyclohexa-2,4-dien-1-yl]-4-methylpentan-2-yl] (2S)-2-aminopropanoate
CID 138507520
5-fluoro-2,6-dimethylcyclohexa-1,3-diene
CID 89049672
(1R,2S)-4-methylcyclohexa-3,5-diene-1,2-diol
CID 25203479
3,6-dimethylcyclohexa-2,4-dien-1-ol
CID 154059355
2,5-dimethyl-6-[(E)-prop-1-enyl]cyclohexa-1,3-diene
CID 142132615
(1R,2S)-4-methylcyclohexa-3,5-diene-1,2-dicarboxylic acid
CID 175022944
(E)-1-(4-fluoro-6-methylcyclohexa-2,4-dien-1-yl)-2-methylbut-2-en-1-amine
CID 143371488
2-methyl-5-(2-methylpropyl)cyclopenta-1,3-diene;zirconium
CID 174493510
2,6-dimethyl-5-(3-methyloctan-2-yl)cyclohexa-1,3-diene;ethane;ethene;ethylcyclopropane;(3E)-3-ethyl-6-methylhepta-3,5-diene-2-thione
CID 143369092
(6S)-2,6-dimethyl-5-phenylsulfanylcyclohexa-1,3-diene
CID 71215581
ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene
CID 143684715

Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol?
The IUPAC name of 1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol (CID 90828048) is 1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol.
What is the SMILES notation for 1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol?
The canonical SMILES for 1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol is CC1=CC(C)C(C(C)O)C=C1.
What is the InChIKey of 1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol?
The InChIKey is NLBQBYFAUZEOJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-7-4-5-10(9(3)11)8(2)6-7/h4-6,8-11H,1-3H3.
What are the key properties of 1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol?
1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol has a molecular weight of 152.24 g/mol, XLogP of 2.14, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethylcyclohexa-2,4-dien-1-yl)ethanol is sourced from PubChem (CID 90828048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).