HHCB

Synonyms: "galaxolide", "abbalide", "pearlide", "galaxolide white"

Source: HHCB is used to make a fragrance long lasting and have a positive technical effect on its balance bringing the initial and residual smell into harmony.

Identifiers:

IUPAC Name: 4,6,6,7,8,8-hexamethyl-1,3,4,7-tetrahydrocyclopenta[g]isochromene
CAS Number: 1222-05-5
PubChem ID: 91497
InChiKey: ONKNPOPIGWHAQC-UHFFFAOYSA-N
Canonical SMILES: CC1COCC2=CC3=C(C=C12)C(C(C3(C)C)C)(C)C

Structural Properties:

Molecular Formula: C18H26O
Molecular Weight: 258.398

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 1
Number of atoms different from hydrogen: 19

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2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors
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Mori T, Iida M, Ishibashi H, Kohra S, Takao Y, Takemasa T, Arizono K. 2007. Hormonal activity of polycyclic musks evaluated by reporter gene assay. Environ Sci 14(4):195-202.

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2D-structure

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3D-structure

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