2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol

C17H26O — CID 71521561

IUPAC2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol
SMILESCC(C)(O)c1ccc2c(c1)C(C)(C)CCC2(C)C
InChIInChI=1S/C17H26O/c1-15(2)9-10-16(3,4)14-11-12(17(5,6)18)7-8-13(14)15/h7-8,11,18H,9-10H2,1-6H3
InChIKeyXDESNCSZWOIXMA-UHFFFAOYSA-N
MW246.39 g/mol
LogP4.26
Rot. Bonds1

About 2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol

2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol (PubChem CID 71521561) has the molecular formula C17H26O and a molecular weight of 246.39 g/mol. Its IUPAC name is 2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol
PubChem CID71521561
Molecular FormulaC17H26O
Molecular Weight246.39 g/mol
Exact Mass246.20
IUPAC Name2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol
SMILESCC(C)(O)c1ccc2c(c1)C(C)(C)CCC2(C)C
InChIInChI=1S/C17H26O/c1-15(2)9-10-16(3,4)14-11-12(17(5,6)18)7-8-13(14)15/h7-8,11,18H,9-10H2,1-6H3
InChIKeyXDESNCSZWOIXMA-UHFFFAOYSA-N
XLogP4.26
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol?
The IUPAC name of 2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol (CID 71521561) is 2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol.
What is the SMILES notation for 2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol?
The canonical SMILES for 2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol is CC(C)(O)c1ccc2c(c1)C(C)(C)CCC2(C)C.
What is the InChIKey of 2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol?
The InChIKey is XDESNCSZWOIXMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O/c1-15(2)9-10-16(3,4)14-11-12(17(5,6)18)7-8-13(14)15/h7-8,11,18H,9-10H2,1-6H3.
What are the key properties of 2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol?
2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol has a molecular weight of 246.39 g/mol, XLogP of 4.26, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propan-2-ol is sourced from PubChem (CID 71521561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).