2-(2-methylpropoxy)cyclohex-2-en-1-ol

C10H18O2 — CID 13333792

IUPAC2-(2-methylpropoxy)cyclohex-2-en-1-ol
SMILESCC(C)COC1=CCCCC1O
InChIInChI=1S/C10H18O2/c1-8(2)7-12-10-6-4-3-5-9(10)11/h6,8-9,11H,3-5,7H2,1-2H3
InChIKeyXAHWXFNNFJCHJR-UHFFFAOYSA-N
MW170.25 g/mol
LogP2.09
Rot. Bonds3

About 2-(2-methylpropoxy)cyclohex-2-en-1-ol

2-(2-methylpropoxy)cyclohex-2-en-1-ol (PubChem CID 13333792) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 2-(2-methylpropoxy)cyclohex-2-en-1-ol.

Molecular Properties

Compound Name2-(2-methylpropoxy)cyclohex-2-en-1-ol
PubChem CID13333792
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name2-(2-methylpropoxy)cyclohex-2-en-1-ol
SMILESCC(C)COC1=CCCCC1O
InChIInChI=1S/C10H18O2/c1-8(2)7-12-10-6-4-3-5-9(10)11/h6,8-9,11H,3-5,7H2,1-2H3
InChIKeyXAHWXFNNFJCHJR-UHFFFAOYSA-N
XLogP2.09
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropoxy)cyclohex-2-en-1-ol?
The IUPAC name of 2-(2-methylpropoxy)cyclohex-2-en-1-ol (CID 13333792) is 2-(2-methylpropoxy)cyclohex-2-en-1-ol.
What is the SMILES notation for 2-(2-methylpropoxy)cyclohex-2-en-1-ol?
The canonical SMILES for 2-(2-methylpropoxy)cyclohex-2-en-1-ol is CC(C)COC1=CCCCC1O.
What is the InChIKey of 2-(2-methylpropoxy)cyclohex-2-en-1-ol?
The InChIKey is XAHWXFNNFJCHJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-8(2)7-12-10-6-4-3-5-9(10)11/h6,8-9,11H,3-5,7H2,1-2H3.
What are the key properties of 2-(2-methylpropoxy)cyclohex-2-en-1-ol?
2-(2-methylpropoxy)cyclohex-2-en-1-ol has a molecular weight of 170.25 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropoxy)cyclohex-2-en-1-ol is sourced from PubChem (CID 13333792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).