3-Heptyl-2-((3-heptyl-4-methylthiazol-2(3H)-ylidene)methyl)-4-methylthiazol-3-ium iodide
Basic information
- CAS
15763-48-1- Standard SMILES
CCCCCCCN1C(C)=CSC1=Cc1scc(C)[n+]1CCCCCCC.[I-]- InChIKey
DQYSALLXMHVJAV-UHFFFAOYSA-M- Molecular formula
- C23H39IN2S2
- Average molar mass
- 534.6 g/mol
- Monoisotopic mass
- 534.15994
Overview
See also: Pionin (preferred).
Names & identifiers
- Preferred name
- 3-Heptyl-2-((3-heptyl-4-methylthiazol-2(3H)-ylidene)methyl)-4-methylthiazol-3-ium iodide
- IUPAC
- 3-heptyl-2-[(3-heptyl-4-methyl-1,3-thiazol-3-ium-2-yl)methylidene]-4-methyl-1,3-thiazole iodide
- English name
- Quaternium-73
- Molecular formula
- C23H39IN2S2
- Molecular weight
- 534.6
Names & synonyms
3-Heptyl-2-((3-heptyl-4-methylthiazol-2(3H)-ylidene)methyl)-4-methylthiazol-3-ium iodideQuaternium 73(E)-3-Heptyl-2-((3-heptyl-4-methylthiazol-2(3H)-ylidene)methyl)-4-methylthiazol-3-ium iodide(Z)-3-Heptyl-2-((3-heptyl-4-methylthiazol-2(3H)-ylidene)methyl)-4-methylthiazol-3-ium iodide1619969-13-9SCHEMBL31167384C23H39IN2S2DTXSID40935746Thiazolium, 3-heptyl-2-[(3-heptyl-4-methyl-2(3H)-thiazolylidene)methyl]-4-methyl-, iodide (1:1)DB-252498NS00014033NS00085309
Show more names
PioninPolyquaternium-73BIOXYNEQuaternim-73QUATERNIUM-73Pionin,PurininQuaternium-73,PIONINPionin, Quaternium-73Quaternium-73（Pionine）Quaternary ammonium-73
H204733-heptyl-2-[(3-heptyl-4-methyl-thiazol-3-ium-2-yl)methylene]-4-methyl-thiazole;iodide3-Heptyl-2-[(3-heptyl-4-methyl-1,3-thiazol-2(3H)-ylidene)methyl]-4-methyl-1,3-thiazol-3-ium iodide3-heptyl-2-[(3-heptyl-4-methyl-1,3-thiazol-3-ium-2-yl)methylidene]-4-methyl-1,3-thiazole;iodide
Properties
Computed structural properties
- Topological polar surface area
- 60.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 434
Physicochemical properties
- Cosmetics Ingredients Functions
- ANTISTATICHAIR CONDITIONINGFILM FORMINGHAIR FIXING
- InChI
- InChI=1S/C23H39N2S2.HI/c1-5-7-9-11-13-15-24-20(3)18-26-22(24)17-23-25(21(4)19-27-23)16-14-12-10-8-6-2;/h17-19H,5-16H2,1-4H3;1H/q+1;/p-1
- InChIKey
- DQYSALLXMHVJAV-UHFFFAOYSA-M
- SMILES
- C(C1SC=C(C)[N+]=1CCCCCCC)=C1SC=C(C)N1CCCCCCC.[I-]
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 5 X73DDS97A · 5X73DDS97A
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
UsesQuaternium-73 has inhibiting effect on bacteria and a variety of fungi at a low concentration. Particularly, Quaternium-73 has strong anti-bacterial effect on Propionibacterium, it can improve the symptoms of acne and frequently occurring acne. In addition, quaternium-73 can inhibit melanin production, it has high safety and good thermal stability. Quaternium-73 is recommended for use in anti-acne, anti-bacterial, whitening and anti-spot products.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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