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
- Formal charge
- 0
- Complexity
- 338
Related reactions
16 records
Linked notes
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