2,3,4,4-tetramethylcyclohex-2-en-1-ol

C10H18O — CID 21015437

IUPAC2,3,4,4-tetramethylcyclohex-2-en-1-ol
SMILESCC1=C(C)C(C)(C)CCC1O
InChIInChI=1S/C10H18O/c1-7-8(2)10(3,4)6-5-9(7)11/h9,11H,5-6H2,1-4H3
InChIKeyZEMBHLUOXBIQRJ-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.50
Rot. Bonds

About 2,3,4,4-tetramethylcyclohex-2-en-1-ol

2,3,4,4-tetramethylcyclohex-2-en-1-ol (PubChem CID 21015437) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 2,3,4,4-tetramethylcyclohex-2-en-1-ol.

Molecular Properties

Compound Name2,3,4,4-tetramethylcyclohex-2-en-1-ol
PubChem CID21015437
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name2,3,4,4-tetramethylcyclohex-2-en-1-ol
SMILESCC1=C(C)C(C)(C)CCC1O
InChIInChI=1S/C10H18O/c1-7-8(2)10(3,4)6-5-9(7)11/h9,11H,5-6H2,1-4H3
InChIKeyZEMBHLUOXBIQRJ-UHFFFAOYSA-N
XLogP2.50
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.50
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

6-methoxy-1,2,3,3-tetramethylcyclohexene
CID 11041115
methyl 3-hydroxy-2,6,6-trimethylcyclohexene-1-carboxylate
CID 10965493
(3-hydroxy-2,6,6-trimethylcyclohexen-1-yl)methanesulfinate
CID 20692273
3-(3-hydroxy-2,6,6-trimethylcyclohexen-1-yl)prop-2-enoic acid
CID 66855769
(1S)-2,4,4-trimethyl-3-[2-(2-methyl-1,3-dioxolan-2-yl)ethenyl]cyclohex-2-en-1-ol
CID 90799403
3-(4-hydroxyhexa-2,5-dien-2-yl)-2,4,4-trimethylcyclohex-2-en-1-ol
CID 70590161
(1Z)-1,2,3,3,6-pentamethylcyclooctene
CID 142284308
2,4,4-trimethyl-3-[(2E,4E)-3-methyl-5-phosphanylpenta-2,4-dienyl]cyclohex-2-en-1-ol
CID 141144143
1-iodo-2,3,3,6,6-pentamethylcyclohexene
CID 146379857
(2E,4E,6E,8E)-9-(3-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3,7-dimethylnona-2,4,6,8-tetraenal
CID 6029647
4-[3-(3-hydroxy-2,6,6-trimethylcyclohexen-1-yl)prop-2-enoyl]piperazine-1-carboxylic acid
CID 66855941
(2Z,4E,6E,8E)-9-[(3S)-3-hydroxy-2,6,6-trimethylcyclohexen-1-yl]-3,7-dimethylnona-2,4,6,8-tetraenal
CID 177476454

Frequently Asked Questions

What is the IUPAC name of 2,3,4,4-tetramethylcyclohex-2-en-1-ol?
The IUPAC name of 2,3,4,4-tetramethylcyclohex-2-en-1-ol (CID 21015437) is 2,3,4,4-tetramethylcyclohex-2-en-1-ol.
What is the SMILES notation for 2,3,4,4-tetramethylcyclohex-2-en-1-ol?
The canonical SMILES for 2,3,4,4-tetramethylcyclohex-2-en-1-ol is CC1=C(C)C(C)(C)CCC1O.
What is the InChIKey of 2,3,4,4-tetramethylcyclohex-2-en-1-ol?
The InChIKey is ZEMBHLUOXBIQRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-7-8(2)10(3,4)6-5-9(7)11/h9,11H,5-6H2,1-4H3.
What are the key properties of 2,3,4,4-tetramethylcyclohex-2-en-1-ol?
2,3,4,4-tetramethylcyclohex-2-en-1-ol has a molecular weight of 154.25 g/mol, XLogP of 2.50, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,4-tetramethylcyclohex-2-en-1-ol is sourced from PubChem (CID 21015437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).