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Acetoxy-1-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthyl)ethane

HCID 21474567
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CC(=O)OC(C)c1ccc2c(c1)C(C)(C)CCC2(C)C
InChIKey
IYGLJKSAUMPNIM-UHFFFAOYSA-N
Molecular formula
C18H26O2
Average molar mass
274.4 g/mol

Names & identifiers

Preferred name
Acetoxy-1-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthyl)ethane
IUPAC
1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethyl acetate

Names & synonyms

SCHEMBL8839232IYGLJKSAUMPNIM-UHFFFAOYSA-Nacetoxy-1-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthyl)ethane(+/-)-acetoxy-1-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthyl)ethane

Database identifiers

PubChem CID
21474567

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
20
Formal charge
0
Complexity
370

Related reactions

3 records
New reaction record
HRID 1756465 reaction equation
HRID 1756465As reactantuspto-grants-1995_08
HRID 2294591 reaction equation
HRID 2294591As productAs reactantuspto-grants-1997_11
HRID 2348187 reaction equation
HRID 2348187As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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