3-Hydroxy-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid

HCID 10682016

Basic information

Standard SMILES
CC1(C)CCC(C)(C)c2cc(C(=O)O)c(O)cc21
InChIKey
BPWJFRMNQQXQHD-UHFFFAOYSA-N
Molecular formula
C15H20O3
Average molar mass
248.32 g/mol
Monoisotopic mass
248.1412445

Names & identifiers

Preferred name
3-Hydroxy-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
IUPAC
3-hydroxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carboxylic acid

Names & synonyms

191469-54-23-Hydroxy-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acidCHEMBL540743SCHEMBL7149480SCHEMBL30701833BPWJFRMNQQXQHD-UHFFFAOYSA-N7-hydroxy-1,1,4,4-tetramethyl-tetralin-6-carboxylic acid5,6,7,8-tetrahydro-5,5,8,8-tetra- methyl-2-hydroxynaphthalene-3-carboxylic acid5,6,7,8-tetrahydro-5,5,8,8-tetra-methyl-2-hydroxynaphthalene-3-carboxylic acid5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-hydroxynaphthalene-3-carboxylic acid

Database identifiers

PubChem CID
10682016
ChEMBL
CHEMBL540743

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
57.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
18

Related reactions

18 records

Compound notes

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