2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol

C99H198O9 — CID 159132183

IUPAC2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1C(C)CC(O)CC1C.CC(C)C1C(C)CCC(C)C1O.CC(C)C1CC(C)C(C)CC1O.CC(C)C1CC(C)C(O)C(C)C1.CC(C)C1CC(C)C(O)CC1C.CC(C)C1CCC(C)C(C)C1O.CC(C)C1CCC(O)C(C)C1C.CC1CC(C)C(C(C)C)C(O)C1.CC1CC(C)C(O)C(C(C)C)C1
InChIInChI=1S/9C11H22O/c1-7(2)10-5-9(4)11(12)6-8(10)3;1-7(2)11-8(3)5-10(12)6-9(11)4;1-7(2)10-5-8(3)11(12)9(4)6-10;1-7(2)10-5-8(3)9(4)6-11(10)12;1-7(2)11-9(4)5-8(3)6-10(11)12;1-7(2)10-6-8(3)5-9(4)11(10)12;1-7(2)10-5-6-11(12)9(4)8(10)3;1-7(2)10-6-5-8(3)9(4)11(10)12;1-7(2)10-8(3)5-6-9(4)11(10)12/h9*7-12H,5-6H2,1-4H3
InChIKeyKHAOVIRKEPJQQT-UHFFFAOYSA-N
MW1532.66 g/mol
LogP24.17
Rot. Bonds9

About 2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol

2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol (PubChem CID 159132183) has the molecular formula C99H198O9 and a molecular weight of 1532.66 g/mol. Its IUPAC name is 2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol
PubChem CID159132183
Molecular FormulaC99H198O9
Molecular Weight1532.66 g/mol
Exact Mass1531.50
IUPAC Name2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1C(C)CC(O)CC1C.CC(C)C1C(C)CCC(C)C1O.CC(C)C1CC(C)C(C)CC1O.CC(C)C1CC(C)C(O)C(C)C1.CC(C)C1CC(C)C(O)CC1C.CC(C)C1CCC(C)C(C)C1O.CC(C)C1CCC(O)C(C)C1C.CC1CC(C)C(C(C)C)C(O)C1.CC1CC(C)C(O)C(C(C)C)C1
InChIInChI=1S/9C11H22O/c1-7(2)10-5-9(4)11(12)6-8(10)3;1-7(2)11-8(3)5-10(12)6-9(11)4;1-7(2)10-5-8(3)11(12)9(4)6-10;1-7(2)10-5-8(3)9(4)6-11(10)12;1-7(2)11-9(4)5-8(3)6-10(11)12;1-7(2)10-6-8(3)5-9(4)11(10)12;1-7(2)10-5-6-11(12)9(4)8(10)3;1-7(2)10-6-5-8(3)9(4)11(10)12;1-7(2)10-8(3)5-6-9(4)11(10)12/h9*7-12H,5-6H2,1-4H3
InChIKeyKHAOVIRKEPJQQT-UHFFFAOYSA-N
XLogP24.17
TPSA182.07 Ų
H-Bond Donors9
H-Bond Acceptors9
Rotatable Bonds9
Heavy Atoms108
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001532.66
LogP ≤ 524.17
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 109

Analyze 2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol (CID 159132183) is 2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol is CC(C)C1C(C)CC(O)CC1C.CC(C)C1C(C)CCC(C)C1O.CC(C)C1CC(C)C(C)CC1O.CC(C)C1CC(C)C(O)C(C)C1.CC(C)C1CC(C)C(O)CC1C.CC(C)C1CCC(C)C(C)C1O.CC(C)C1CCC(O)C(C)C1C.CC1CC(C)C(C(C)C)C(O)C1.CC1CC(C)C(O)C(C(C)C)C1.
What is the InChIKey of 2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol?
The InChIKey is KHAOVIRKEPJQQT-UHFFFAOYSA-N. The full InChI is InChI=1S/9C11H22O/c1-7(2)10-5-9(4)11(12)6-8(10)3;1-7(2)11-8(3)5-10(12)6-9(11)4;1-7(2)10-5-8(3)11(12)9(4)6-10;1-7(2)10-5-8(3)9(4)6-11(10)12;1-7(2)11-9(4)5-8(3)6-10(11)12;1-7(2)10-6-8(3)5-9(4)11(10)12;1-7(2)10-5-6-11(12)9(4)8(10)3;1-7(2)10-6-5-8(3)9(4)11(10)12;1-7(2)10-8(3)5-6-9(4)11(10)12/h9*7-12H,5-6H2,1-4H3.
What are the key properties of 2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol?
2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol has a molecular weight of 1532.66 g/mol, XLogP of 24.17, 9 rotatable bonds, 9 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,3-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,4-dimethyl-6-propan-2-ylcyclohexan-1-ol;2,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;2,6-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-2-propan-2-ylcyclohexan-1-ol;3,5-dimethyl-4-propan-2-ylcyclohexan-1-ol;3,6-dimethyl-2-propan-2-ylcyclohexan-1-ol;4,5-dimethyl-2-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 159132183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).