Polyquaternium 1
Also known as Polidronium chloride, dimethyl-bis[(E)-4-[tris(2-hydroxyethyl)azaniumyl]but-2-enyl]azanium, trichloride, C22H48Cl3N3O6
Key facts
What buyers check first
- CAS number
- 75345-27-6
- Formula
- C22H48Cl3N3O6
- Molar mass
- 557.00 g/mol
- EC number
- 688-145-1
- HS code
- 292390
- Category
- Polymers and thermoplastics
What is Polyquaternium 1?
Plain description, key identifiers and synonyms
Polidronium chloride is a quaternary ammonium salt.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- dimethyl-bis[(E)-4-[tris(2-hydroxyethyl)azaniumyl]but-2-enyl]azanium trichloride
- CAS number
- 75345-27-6 CAS number cross-checked
- EC number
- 688-145-1
- Molecular formula
- C22H48Cl3N3O6
- MDL number
- MFCD28978359
- INCI name
- POLYQUATERNIUM-1
- InChIKey
- OTIWYSKRSMXGNK-VHJGTCNUSA-K
- InChI
- InChI=1S/C22H48N3O6.3ClH/c1-23(2,7-3-5-9-24(11-17-26,12-18-27)13-19-28)8-4-6-10-25(14-20-29,15-21-30)16-22-31;;;/h3-6,26-31H,7-22H2,1-2H3;3*1H/q+3;;;/p-3/b5-3+,6-4+;;;
- Canonical SMILES
- C[N+](C)(CC=CC[N+](CCO)(CCO)CCO)CC=CC[N+](CCO)(CCO)CCO.[Cl-].[Cl-].[Cl-]
- Isomeric SMILES
- C[N+](C/C=C/C[N+](CCO)(CCO)CCO)(C/C=C/C[N+](CCO)(CCO)CCO)C.[Cl-].[Cl-].[Cl-]
Synonyms
- Polidronium chloride
- dimethyl-bis[(E)-4-[tris(2-hydroxyethyl)azaniumyl]but-2-enyl]azanium, trichloride
- C22H48Cl3N3O6
- Polidronium chloride (JAN/INN)
- [(E)-4-[dimethyl-[(E)-4-[tris(2-hydroxyethyl)azaniumyl]but-2-enyl]azaniumyl]but-2-enyl]-tris(2-hydroxyethyl)azanium trichloride
- dimethyl-bis[(E)-4-[tris(2-hydroxyethyl)ammonio]but-2-enyl]ammonium, trichloride
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 557.00 g/molcalc.Computed value |
|---|---|
| Exact mass | 555.2609 Dacalc.Computed value |
| LogP (octanol/water) | -11.23calc.Computed value |
| Topological polar surface area | 121.4 Ųcalc.Computed value |
| Hydrogen bond donors | 6calc.Computed value |
| Hydrogen bond acceptors | 6calc.Computed value |
| Rotatable bonds | 20calc.Computed value |
| Heavy atoms | 34calc.Computed value |
| Rings | 0calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.82calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Components | 4calc.Computed value |
| Lipinski rule of five | Fails (2 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H400Very toxic to aquatic life.
Precautionary statements (3)
- P273Avoid release to the environment.
- P391Collect spillage.
- P501Dispose of contents and container in accordance with local regulations.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aidPolyquaternium 1 suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- ChinaUnclaimed profilePolyquaternium 1Grade, purity and minimum order on requestPrice on request
- China, Shanghai ManufacturerUnclaimed profilePolyquaternium 1Grade, purity and minimum order on requestPrice on request
- China ManufacturerUnclaimed profilePolyquaternium 1Grade, purity and minimum order on requestPrice on request
- China ManufacturerUnclaimed profilePolyquaternium 1Grade, purity and minimum order on requestPrice on request
- China ManufacturerUnclaimed profilePolyquaternium 1Grade, purity and minimum order on requestPrice on request
- China, TianjinUnclaimed profilePolyquaternium 1Grade, purity and minimum order on requestPrice on request
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Where suppliers are based
6 suppliers in 1 country
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Polyquaternium 1 price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Use classes: Cosmetics.
Industries and functions
Cosmetic ingredient, INCI name POLYQUATERNIUM-1(film forming)
Functional uses
- Surfactant (surface active agent)
Cosmetic functions
- Film forming
Regulatory status
Inventories, regulations and trade controls that list this substance
Health and food
- EU cosmetic ingredient inventory
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Polyquaternium 1 is traded under.
Quaternary ammonium salts and hydroxides whether or not chemically defined not elsewhere classified…
- China36.7%
- United States14.2%
- Netherlands9.4%
- South Korea10.7%
- Germany10.1%
- United States9.9%
The HS code shown for Polyquaternium 1 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Polyquaternium 1, based on the data on this page
What is Polyquaternium 1?
What is the CAS number of Polyquaternium 1?
What is the molecular formula and weight of Polyquaternium 1?
What is Polyquaternium 1 used for?
Is Polyquaternium 1 hazardous?
What is the HS code of Polyquaternium 1?
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What is the price of Polyquaternium 1?
Guides for buyers
Practical guides that help when you source, ship or handle Polyquaternium 1
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
- Article, QualityWhat a certificate of analysis should containThe parts of a complete COA, how to read it against your specification, the warning signs of a weak or copied certificate and how to verify results.Read
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