Compound: Galaxolide
SMILES: O1Cc2c(cc3C(C)(C)C(C(c3c2)(C)C)C)C(C1)C
InChIKey: ONKNPOPIGWHAQC-UHFFFAOYSA-N
Synonyms: Galaxolide, 1222-05-5, Abbalide, Galoxolide, HHCB, Pearlide, Galaxolide White, hexamethylindanopyran, Cyclopenta[g]-2-benzopyran, 1,3,4,6,7,8-hexahydro-4,6,6,7,8,8-hexamethyl-, Hexahydrohexamethyl cyclopentabenzopyran, 1,3,4,6,7,8-Hexahydro-4,6,6,7,8,8-hexamethyl-cyclopenta-gamma-2-benzopyran, 14170060AT, CHEBI:83784, Hexahydro-4,6,6,7,8,8-hexamethylcyclopenta-gamma-2-benzopyran, 1,3,4,6,7,8-Hexahydro-4,6,6,7,8,8-hexamethylindeno(5,6-c)pyran, Cyclopenta(g)-2-benzopyran, 1,3,4,6,7,8-hexahydro-4,6,6,7,8,8-hexamethyl-, 1,3,4,6,7,8-hexahydro-4,6,6,7,8,8-hexamethylindeno[5,6-c]pyran, hexahydro-hexamethylcyclopenta-benzopyran, RefChem:633508, 214-946-9, 4,6,6,7,8,8-Hexamethyl-1,3,4,6,7,8-hexahydrocyclopenta[g]isochromene, 1,3,4,6,7,8-Hexahydro-4,6,6,7,8,8-hexamethylcyclopenta[g]-2-benzopyran, 4,6,6,7,8,8-hexamethyl-1,3,4,7-tetrahydrocyclopenta[g]isochromene, 1,3,4,6,7,8-Hexahydro-4,6,6,7,8,8-hexamethylcyclopenta(g)-2-benzopyran, EINECS 214-946-9, CCRIS 8402, DTXSID8027373, Galaxolide 1, HSDB 7514, UNII-14170060AT, Galaxolide 1+2, 4-(2-Aminoethyl)-5-nitropyrocatechol; 4-(2-Aminoethyl)-5-nitro-1,2-benzenediol; 4-(2-Aminoethyl)-5-nitrobenzene-1,2-diol, indeno[5,6-c]pyran, 1,3,4,6,7,8-hexahydro-4,6,6,7,8,8-hexamethyl-, GALAXOLIDE [HSDB], HHCB [MI], EC 214-946-9, SCHEMBL115118, orb2802502, orb3025512, CHEMBL1883305, SCHEMBL29371876, HHCB 10 microg/mL in Isooctane, 4,6,6,7,8,8-Hexamethyl-1,3,4,6,7,8-hexahydroindeno[5,6-c]pyran, 4,6,6,7,8,8-hexamethyl-1H,3H,4H,6H,7H,8H-indeno[5,6-c]pyran, MFCD00072199, MFCD00217003, Galaxolide - Mixture of Diastereomers, AKOS016010343, FG23642, FG45940, s12385, NCGC00164416-01, NCGC00164416-02, 1,3,4,6,7,8-Hexahydro-4,6,6,7,8,8-hexamethylcyclopenta[g]-2-benzopyran (ca. 50% in Diethyl Phthalate), CS-0152668, G0415, NS00008760, Galaxolide solution, 50% in diethyl phthalate, Q2268349, 4,6,6,7,8,8-Hexamethyl-1,3,4,6,7,8-hexahydrocyclopenta[g]isochromene #, 1,3,4,6,7,8-hexahydro-4,6,6,7,8,8-hexamethyl-cyclopenta[G]-2-benzopyran, 1,3,4,6,7,8-Hexahydro-4,6,6,7,8,8-hexamethylcyclopenta[g]-2-b enzopyrane
Theoretical properties:
molecular_formula: C18H26O
molecular_weight: 258.4 g/mol
exact_mass: 258.198365449 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 1
rotatable_bond_count: 0
heavy_atom_count: 19
topological_polar_surface_area: 9.2 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: Colorless crystals from ethanol
color: Colorless crystals from ethanol
odor: Strong musk odor
boiling_point: BP: 128 °C at 0.8 mm Hg
melting_point: 57-58 °C
density: 1.0054 at 20 °C/4 °C
solubility: In water, 1.75 mg/L at 25 °C
vapor_pressure: 0.00054 [mmHg]
Descriptions:
pubchem: Galaxolide is an organic heterotricyclic compound that is 1,3,4,6,7,8-hexahydrocyclopenta[g]isochromene substituted by methyl groups at positions 4, 6, 6, 7, 8 and 8 respectively. It is a synthetic musk used as a fragrance in cosmetics. It has a role as a fragrance. It is an organic heterotricyclic compound and a member of isochromenes.
chebi: An organic heterotricyclic compound that is 1,3,4,6,7,8-hexahydrocyclopenta[<em>g</em>]isochromene substituted by methyl groups at positions 4, 6, 6, 7, 8 and 8 respectively. It is a synthetic musk used as a fragrance in cosmetics.
chembl: Unnamed Compound is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Galaxolide (trade name; also known as Abbalide, Pearlide, Astrolide, Musk 50, Polarlide; chemical name 1,3,4,6,7,8-hexahydro-4,6,6,7,8,8,-hexamethyl-cyclopenta[g]benzopyran or HHCB, hexamethylindanopyran) is a synthetic musk with a clean sweet musky floral woody odor used in fragrances. It is one of the musk components that perfume and cologne manufacturers use to add a musk odor to their products. Galaxolide was first synthesized in 1956, and used in the late 1960s in some fabric softeners and detergents. High concentrations were also incorporated in fine fragrances.