4-ethyl-6-methylcyclohexa-1,3-dien-1-ol

C9H14O — CID 89168484

IUPAC4-ethyl-6-methylcyclohexa-1,3-dien-1-ol
SMILESCCC1=CC=C(O)C(C)C1
InChIInChI=1S/C9H14O/c1-3-8-4-5-9(10)7(2)6-8/h4-5,7,10H,3,6H2,1-2H3
InChIKeyRSMCSPXJNHMVGG-UHFFFAOYSA-N
MW138.21 g/mol
LogP2.80
Rot. Bonds1

About 4-ethyl-6-methylcyclohexa-1,3-dien-1-ol

4-ethyl-6-methylcyclohexa-1,3-dien-1-ol (PubChem CID 89168484) has the molecular formula C9H14O and a molecular weight of 138.21 g/mol. Its IUPAC name is 4-ethyl-6-methylcyclohexa-1,3-dien-1-ol.

Molecular Properties

Compound Name4-ethyl-6-methylcyclohexa-1,3-dien-1-ol
PubChem CID89168484
Molecular FormulaC9H14O
Molecular Weight138.21 g/mol
Exact Mass138.10
IUPAC Name4-ethyl-6-methylcyclohexa-1,3-dien-1-ol
SMILESCCC1=CC=C(O)C(C)C1
InChIInChI=1S/C9H14O/c1-3-8-4-5-9(10)7(2)6-8/h4-5,7,10H,3,6H2,1-2H3
InChIKeyRSMCSPXJNHMVGG-UHFFFAOYSA-N
XLogP2.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethyl-5-methylcyclohexa-1,3-diene
CID 123887743
1-ethyl-4-methyl-3-methylidenecyclopentene;propane
CID 143374354
3-methylcyclopropen-1-ol
CID 173486632
1-[4-(bromomethyl)-6-methylcyclohexa-1,3-dien-1-yl]ethanone
CID 130445398
(Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene
CID 143221988
3-ethyl-1,6-dimethyl-2H-pyridine
CID 143526306
1-ethyl-4-hydroperoxy-3,5-dimethylcyclohexene
CID 89076598
(4-ethyl-2,6-dimethylcyclohex-3-en-1-yl)methanol
CID 89004722
1-ethyl-4-propylcyclopenta-1,3-diene
CID 139667468
5-ethyl-2-nitrocyclohexa-2,4-diene-1-carbonitrile
CID 100963230
3-ethyl-5-methyl-2H-pyrrole
CID 23564163
1-(4-ethylcyclopenta-1,3-dien-1-yl)propan-1-one
CID 20755925

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-methylcyclohexa-1,3-dien-1-ol?
The IUPAC name of 4-ethyl-6-methylcyclohexa-1,3-dien-1-ol (CID 89168484) is 4-ethyl-6-methylcyclohexa-1,3-dien-1-ol.
What is the SMILES notation for 4-ethyl-6-methylcyclohexa-1,3-dien-1-ol?
The canonical SMILES for 4-ethyl-6-methylcyclohexa-1,3-dien-1-ol is CCC1=CC=C(O)C(C)C1.
What is the InChIKey of 4-ethyl-6-methylcyclohexa-1,3-dien-1-ol?
The InChIKey is RSMCSPXJNHMVGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O/c1-3-8-4-5-9(10)7(2)6-8/h4-5,7,10H,3,6H2,1-2H3.
What are the key properties of 4-ethyl-6-methylcyclohexa-1,3-dien-1-ol?
4-ethyl-6-methylcyclohexa-1,3-dien-1-ol has a molecular weight of 138.21 g/mol, XLogP of 2.80, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-methylcyclohexa-1,3-dien-1-ol is sourced from PubChem (CID 89168484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).