5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde

C15H20O — CID 10420887

IUPAC5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde
SMILESCC1(C)CCC(C)(C)c2cc(C=O)ccc21
InChIInChI=1S/C15H20O/c1-14(2)7-8-15(3,4)13-9-11(10-16)5-6-12(13)14/h5-6,9-10H,7-8H2,1-4H3
InChIKeyRRAGXXOTEICTAF-UHFFFAOYSA-N
MW216.32 g/mol
LogP3.85
Rot. Bonds1

About 5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde

5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde (PubChem CID 10420887) has the molecular formula C15H20O and a molecular weight of 216.32 g/mol. Its IUPAC name is 5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde.

Molecular Properties

Compound Name5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde
PubChem CID10420887
Molecular FormulaC15H20O
Molecular Weight216.32 g/mol
Exact Mass216.15
IUPAC Name5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde
SMILESCC1(C)CCC(C)(C)c2cc(C=O)ccc21
InChIInChI=1S/C15H20O/c1-14(2)7-8-15(3,4)13-9-11(10-16)5-6-12(13)14/h5-6,9-10H,7-8H2,1-4H3
InChIKeyRRAGXXOTEICTAF-UHFFFAOYSA-N
XLogP3.85
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde?
The IUPAC name of 5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde (CID 10420887) is 5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde.
What is the SMILES notation for 5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde?
The canonical SMILES for 5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde is CC1(C)CCC(C)(C)c2cc(C=O)ccc21.
What is the InChIKey of 5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde?
The InChIKey is RRAGXXOTEICTAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O/c1-14(2)7-8-15(3,4)13-9-11(10-16)5-6-12(13)14/h5-6,9-10H,7-8H2,1-4H3.
What are the key properties of 5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde?
5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde has a molecular weight of 216.32 g/mol, XLogP of 3.85, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbaldehyde is sourced from PubChem (CID 10420887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).