6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol

C10H14O — CID 67363361

IUPAC6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol
SMILESC=CCC1(C)CC=CC=C1O
InChIInChI=1S/C10H14O/c1-3-7-10(2)8-5-4-6-9(10)11/h3-6,11H,1,7-8H2,2H3
InChIKeyJGPORCQPTBKPJZ-UHFFFAOYSA-N
MW150.22 g/mol
LogP2.97
Rot. Bonds2

About 6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol

6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol (PubChem CID 67363361) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is 6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol.

Molecular Properties

Compound Name6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol
PubChem CID67363361
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol
SMILESC=CCC1(C)CC=CC=C1O
InChIInChI=1S/C10H14O/c1-3-7-10(2)8-5-4-6-9(10)11/h3-6,11H,1,7-8H2,2H3
InChIKeyJGPORCQPTBKPJZ-UHFFFAOYSA-N
XLogP2.97
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.97
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

2-t-Butyl cresol
CID 22372344
2,6-Di-t-butylcresol
CID 66637192
3-Methyl-[m-cresol]
CID 68881117
2,6-Dimethylcresol
CID 69992119
2,6-Diisopropyl cresol
CID 70389744
2,3,3-Trimethylphenol
CID 129664454
o-Ethyl-cresol
CID 129675303
2-Methyl-[o-cresol]
CID 129821398
3,6-Dimethyl-6-propan-2-ylcyclohexa-1,3-dien-1-ol
CID 163657907
3-(Fluoromethyl)-5,5-dimethylcyclohexa-1,3-dien-1-ol
CID 117755585
5-Prop-1-en-2-yl-5-(trifluoromethyl)cyclohexa-1,3-dien-1-ol
CID 141257136
2-Fluoro-6,6-dimethylcyclohexa-1,3-dien-1-ol
CID 173109976

Frequently Asked Questions

What is the IUPAC name of 6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol?
The IUPAC name of 6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol (CID 67363361) is 6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol.
What is the SMILES notation for 6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol?
The canonical SMILES for 6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol is C=CCC1(C)CC=CC=C1O.
What is the InChIKey of 6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol?
The InChIKey is JGPORCQPTBKPJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O/c1-3-7-10(2)8-5-4-6-9(10)11/h3-6,11H,1,7-8H2,2H3.
What are the key properties of 6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol?
6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol has a molecular weight of 150.22 g/mol, XLogP of 2.97, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-6-prop-2-enylcyclohexa-1,3-dien-1-ol is sourced from PubChem (CID 67363361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).