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(3-Chlor-2-hydroxypropyl)trimethylammoniumchlorid

(3-Chloro-2-hydroxypropyl)trimethylammonium chloride

HCID 18732
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Grundinformationen

CAS
3327-22-8
Standard-SMILES
C[N+](C)(C)CC(O)CCl.[Cl-]
InChIKey
CSPHGSFZFWKVDL-UHFFFAOYSA-M
Summenformel
C6H15ClNO.Cl
Durchschnittliche Molmasse
188,09 g/mol

Überblick

structure in first source

Namen und Bezeichner

Bevorzugter Name
(3-Chloro-2-hydroxypropyl)trimethylammonium chloride
IUPAC
(3-chloro-2-hydroxypropyl)-trimethylazanium chloride
Lokaler Name
(3-Chlor-2-hydroxypropyl)trimethylammoniumchlorid
Englischer Name
3-Chloro-2-hydroxypropyltrimethyl ammonium chloride
Summenformel
C6H15Cl2NO
Molmasse
188.1

Namen und Synonyme

3327-22-8(3-Chloro-2-hydroxypropyl)trimethylammonium chlorideDextrosil1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-trimethyl-, chlorideDTXSID30275343-Chloro-2-hydroxypropylammonium chlorideAPK4X6ZD793-Chloro-2-hydroxypropyltrimethylammonium chlorideNSC-51216AMMONIUM, (3-CHLORO-2-HYDROXYPROPYL)TRIMETHYL-, CHLORIDEDTXCID2075341-Propanaminium, 3-chloro-2-hydroxy-N,N,N-trimethyl-, chloride (1:1)
Weitere Namen anzeigen
CHPTACquabnt21quat188verolankafdowquat188dextrosilkaQuat 188,69%catiomasterc
CHPTAC cpdRefChem:691063-Cl-2-HP-TACl222-048-33-Chloro-2-hydroxypropyltrimethyl ammonium chlorideDextrosil KA(3-Chloro-2-hydroxypropyl)-N,N,N-trimethylammonium chloride3-Chloro-2-hydroxy-N,N,N-trimethylpropan-1-aminium chloride(65% in water)

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA)
20,2 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
3
Schwere Atome
10
Formalladung
0
Komplexität
79,6

Experimentelle und physikochemische Eigenschaften

Density1.2 g/cm³
SolubilitySolubility in water: miscible
Food Contact Substances · 3 Einträge

FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR

FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications

FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications

Physical Description · 2 Einträge

Liquid

COLOURLESS-TO-LIGHT-YELLOW CLEAR ODOURLESS LIQUID.

Physikochemische Eigenschaften

Schmelzpunkt
191 · 191-193°C
Dichte
1.154 g/mL · 1.154 g/mL at 25 °C
Dampfdruck
0.001 Pa · 0.001Pa at 20℃
Brechungsindex
20 · n20/D 1.4541
Flammpunkt
230 °F · >230 °F
storage temp.
Sealed in dry,Room Temperature
Löslichkeit

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 6 Einträge

Warning

H351: Suspected of causing cancer [Warning Carcinogenicity]

P203, P273, P280, P318, P405, and P501 (click each P-code to see the statement)

Warning

H351 (99.9%): Suspected of causing cancer [Warning Carcinogenicity]

P203, P273, P280, P318, P391, P405, and P501 (click each P-code to see the statement)

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: 1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-trimethyl-, chloride

1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-trimethyl-, chloride (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-trimethyl-, chloride (1:1) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 30-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/25086

1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-trimethyl-, chloride: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Other Safety InformationIMAP assessments - 1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-trimethyl-, chloride: Human health tier II assessment
Fire HazardsNot combustible. Gives off irritating or toxic fumes (or gases) in a fire.
Chemical DangersDecomposes on heating. This produces toxic and flammable vapours.
Hazard Classes and Categories · 4 Einträge

Chemie und Industrie

Verwendung und Herstellung

U.S. Production2023: 25,000,000 - <40,000,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesIon exchange agent
General Manufacturing Information · 2 Einträge

Not Known or Reasonably Ascertainable

1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-trimethyl-, chloride (1:1): ACTIVE

Anwendungen

Verwenden3-Chloro-2-hydroxypropyltrimethyl ammonium chloride is used in the preparation of multifunctional cationized cotton fabric based on TiO2 nanomaterials.

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

1-Chlor-2,3-epoxypropan

Zugehörige Reaktionen

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Reaktionsgleichung von HRID 651934
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Reaktionsgleichung von HRID 1194573
HRID 1194573als Produktuspto-grants-1989_03

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Datenbank-Bezeichner

CAS
3327-22-8
PubChem CID
18732
DTXSID
DTXSID3027534
ChEMBL
CHEMBL1866981
UNII
APK4X6ZD79
EC Number
222-048-3
Methanol (Slightly), Water (Sparingly)
Aggregatzustand
clear liquid
Farbe
Colorless to Light yellow
PH
4.8 to · 4.8 to 6.4(50g/L, 25℃)
Wasserlöslichkeit
835.2 g/L · 835.2g/L at 20℃
BRN
6576172 · 6576172
InChI
InChI=1S/C6H15ClNO.ClH/c1-8(2,3)5-6(9)4-7;/h6,9H,4-5H2,1-3H3;1H/q+1;/p-1
InChIKey
CSPHGSFZFWKVDL-UHFFFAOYSA-M
SMILES
[N+](C)(CC(O)CCl)(C)C.[Cl-]
LogP
-1.5 at · -1.5 at 25℃
CAS Datenbank
3327 · 3327-22-8(CAS DataBase Reference)
EPA chemische Informationen
3 · 3-Chloro-2-hydroxypropyltrimethyl ammonium chloride (3327-22-8)

Carc. 2 (99.9%)

Carcinogenicity - category 2

Carcinogenicity - Category 2

Carc. 2

Sicherheit und Schutzausrüstung

Fire FightingIn case of fire in the surroundings, use appropriate extinguishing media. In case of fire: keep drums, etc., cool by spraying with water.
First Aid Measures · 4 Einträge

Fresh air, rest.

Remove contaminated clothes. Rinse and then wash skin with water and soap.

Rinse with plenty of water for several minutes (remove contact lenses if easily possible).

Rinse mouth.

Safe StorageStore in an area without drain or sewer access.
Spillage Disposal · 1 Eintrag

Personal protection: chemical protection suit including self-contained breathing apparatus. Do NOT let this chemical enter the environment. Collect leaking and spilled liquid in sealable containers as far as possible. Absorb remaining liquid in sand or inert absorbent. Then store and dispose of according to local regulations.

Eye PreventionWear safety spectacles.
Inhalation RiskEvaporation at 20 °C is negligible; a harmful concentration of airborne particles can, however, be reached quickly on spraying.
Skin PreventionProtective gloves. Protective clothing.
Exposure PreventionSee EFFECTS OF LONG-TERM OR REPEATED EXPOSURE. AVOID ALL CONTACT!
Ingestion PreventionDo not eat, drink, or smoke during work.
Inhalation PreventionUse closed system or ventilation.
Effects of Long Term ExposureThis substance is possibly carcinogenic to humans.

Toxikologische Informationen

Exposure RoutesThe substance can be absorbed into the body in hazardous amounts by inhalation of its aerosol, through the skin and by ingestion.
ICSC Environmental DataThe substance is harmful to aquatic organisms. The substance may cause long-term effects in the aquatic environment. It is strongly advised not to let the chemical enter into the environment.

Sicherheitsdaten

wgk
2
tsca
TSCA listed
ridadr
2811
hs_code
2923.90.0100
RTECS-Nr.
BP5275400
risk_code
36/37/38-52/53-40
Toxizität
LDLo subcutaneous in mouse: 500mg/kg
hazard_code
Xn
safety_code
26-36-61-36/37
hazard_class
6.1(b)
packing_group
III
Speicherklasse
10 - Combustible liquids
Hazard Classifications
Aquatic Chronic 3Carc. 2