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1-Ethyl-1-[2-(trifluoromethyl)-2-propen-1-yl]-1,2,3,4-tetrahydronaphthalene

HCID 11601435
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
C=C(CC1(CC)CCCc2ccccc21)C(F)(F)F
InChIKey
RBMCKFNUAXOAED-UHFFFAOYSA-N
Molecular formula
C16H19F3
Average molar mass
268.32 g/mol

Names & identifiers

Preferred name
1-Ethyl-1-[2-(trifluoromethyl)-2-propen-1-yl]-1,2,3,4-tetrahydronaphthalene
IUPAC
4-ethyl-4-[2-(trifluoromethyl)prop-2-enyl]-2,3-dihydro-1H-naphthalene

Names & synonyms

1-Ethyl-1-[2-(trifluoromethyl)-2-propen-1-yl]-1,2,3,4-tetrahydronaphthaleneSCHEMBL809227

Database identifiers

PubChem CID
11601435

Properties

Computed structural properties

XLogP
6.4
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
Formal charge
0
Complexity
331

Related reactions

5 records
New reaction record
HRID 119955 reaction equation
HRID 119955As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 600746 reaction equation
HRID 600746As productuspto-grants-2011_03
HRID 600747 reaction equation
HRID 600747As reactantuspto-grants-2011_03
HRID 600749 reaction equation
HRID 600749As reactantuspto-grants-2011_03
HRID 1216010 reaction equation
HRID 1216010As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes