1,1,4,4,7-Pentamethyl-6-ethynyl-1,2,3,4-tetrahydronaphthalene

HCID 11806387

Basic information

Standard SMILES
C#Cc1cc2c(cc1C)C(C)(C)CCC2(C)C
InChIKey
ABEIWZUNWCAUBL-UHFFFAOYSA-N
Molecular formula
C17H22
Average molar mass
226.36 g/mol

Names & identifiers

Preferred name
1,1,4,4,7-Pentamethyl-6-ethynyl-1,2,3,4-tetrahydronaphthalene
IUPAC
6-ethynyl-1,1,4,4,7-pentamethyl-2,3-dihydronaphthalene

Names & synonyms

SCHEMBL3302028ABEIWZUNWCAUBL-UHFFFAOYSA-N1,1,4,4,7-Pentamethyl-6-ethynyl-1,2,3,4-tetrahydronaphthalene(3-methyl-5,5,8,8,-tetramethyl-5,6,7,8-tetrahydronaphth-2-yl)ethyne(3-methyl-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphth-2-yl)ethyne(5,6,7,8-tetrahydro-3,5,5,8,8-pentamethylnaphthalen-2-yl)acetylene(5,6,7,8-tetrahydro-3,5,5,8,8-pentamethylnaphthalen-2yl)acetylene

Database identifiers

PubChem CID
11806387
Nikkaji
J1.552.415D

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
1
Heavy atoms
17

Related reactions

16 records

Linked notes

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