Grundinformationen
- Standard-SMILES
CCCC[N+](CCCC)(CCCC)CCCC.[OH-]- InChIKey
VDZOOKBUILJEDG-UHFFFAOYSA-M- Summenformel
- C16H37NO
- Durchschnittliche Molmasse
- 259,47 g/mol
- Monoisotopische Masse
- 259,2875148
Namen und Bezeichner
- Bevorzugter Name
- Tetrabutylammonium Hydroxide
- IUPAC
- tetrabutylazanium hydroxide
- Lokaler Name
- Tetrabutylammoniumhydroxid
- Englischer Name
- Tetrabutylammonium hydroxide
- Summenformel
- C16H37NO
- Molmasse
- 259.47
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
2052-49-5、65201-77-6- PubChem CID
- 2723671
- DTXSID
DTXSID8062155- ChEMBL
CHEMBL1078154- UNII
- 68I858J9S1
- EC Number
- 218-147-6
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 1 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 12
- Schwere Atome
- 18
- Formalladung
- 0
- Komplexität
- 116
Experimentelle und physikochemische Eigenschaften
Physical Description
Liquid
55% Aqueous solution: Colorless liquid; [Alfa Aesar MSDS]
Physikochemische Eigenschaften
- Schmelzpunkt
- 27 · 27-30 °C(lit.)
- Siedepunkt
- 100 °C · 100 °C
- Dichte
- 0.995 · 0.995
- Dampfdichte
- 1 · 1 (vs air)
- Dampfdruck
- 2.3 kPa · 2.3 kPa (@ 20°C)
- Brechungsindex
- 1.4 · 1.4
- Flammpunkt
- 7 °C · 7°C
- storage temp.
- 30 °C · Store below +30°C.
- Löslichkeit
- Miscible with organic solvents.
- Aggregatzustand
- Solution
- Wichte
- 0.8586 · 0.8586
- Farbe
- 30 · APHA: ≤30
- Geruch (Odor)
- Odorless
- PH
- 14 · 14 (20°C in H2O)
- Explosionsgrenze
- 5.5 · 5.5-36.5% (v/v) Methanol)
- Wasserlöslichkeit
- Soluble in water, methanol.
- BRN
- 3571228 · 3571228
- Stabilität
- Volatile
- InChI
- 1S/C16H36N.H2O/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;/h5-16H2,1-4H3;1H2/q+1;/p-1
- InChIKey
- VDZOOKBUILJEDG-UHFFFAOYSA-M
- SMILES
- [OH-].CCCC[N+](CCCC)(CCCC)CCCC
- LogP
- 1.517 at · 1.517 at 25℃
- CAS Datenbank
- 2052 · 2052-49-5(CAS DataBase Reference)
- EPA chemische Informationen
- 1 · 1-Butanaminium, N,N,N-tributyl-, hydroxide (2052-49-5)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 11.5% (43 of 373) of reports.
Danger
H226 (51.7%): Flammable liquid and vapor [Warning Flammable liquids];H302 (52%): Harmful if swallowed [Warning Acute toxicity, oral];H314 (88.2%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H318 (52.8%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
P210, P233, P240, P241, P242, P243, P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 373 reports by companies from 14 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 43 of 373 reports by companies.;There are 13 notifications provided by 330 of 373 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Regulatory Information
Chemical: 1-Butanaminium, N,N,N-tributyl-, hydroxide
1-Butanaminium, N,N,N-tributyl-, hydroxide (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Butanaminium, N,N,N-tributyl-, hydroxide (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: 13-09-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/19067
1-Butanaminium, N,N,N-tributyl-, hydroxide: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and Categories
Flam. Liq. 3 (51.7%);Acute Tox. 4 (52%);Skin Corr. 1B (88.2%);Eye Dam. 1 (52.8%)
Acute toxicity (ingestion) - category 4;Acute toxicity (dermal) - category 4;Skin corrosion - category 1
Sicherheit und Schutzausrüstung
Protective Action Criteria (PAC)
1.2 [mg/m3]
13 [mg/m3]
79 [mg/m3]
Toxikologische Informationen
Regulatorische Informationen
Regulatory Information
Chemical: 1-Butanaminium, N,N,N-tributyl-, hydroxide
1-Butanaminium, N,N,N-tributyl-, hydroxide (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Butanaminium, N,N,N-tributyl-, hydroxide (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: 13-09-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/19067
1-Butanaminium, N,N,N-tributyl-, hydroxide: Does not have an individual approval but may be used under an appropriate group standard
Sicherheitsdaten
- F
- 9-34
- wgk
- 1
- tsca
- TSCA listed
- ridadr
- UN 3267 8/PG 2
- hs_code
- 29239000
- RTECS-Nr.
- BS5425000
- risk_code
- 34-36/38-23/24/25-11-67-39/23/24/25-36-65-63-38-48/20-35-20/21/22-10-68/20/21/22
- hazard_code
- C,T,F,Xn
- hazard_note
- Highly Flammable/Toxic/Corrosive/Air Sensitive/Hygroscopic
- safety_code
- 7-16-26-36/37/39-45-36/37-62-27
- hazard_class
- 3
- packing_group
- II
- Speicherklasse
- 8A - Combustible corrosive hazardous materials
- Hazard Classifications
- Eye Dam. 1Skin Corr. 1
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological Classification
Purifying or cleansing agents, usually salts of long-chain aliphatic bases or acids, that exert cleansing (oil-dissolving) and antimicrobial effects through a surface action that depends on possessing both hydrophilic and hydrophobic properties.
Verwendung und Herstellung
General Manufacturing Information
Computer and Electronic Product Manufacturing;Synthetic Rubber Manufacturing;Pesticide, Fertilizer, and Other Agricultural Chemical Manufacturing;Pharmaceutical and Medicine Manufacturing;All Other Basic Organic Chemical Manufacturing;Miscellaneous Manufacturing;All Other Chemical Product and Preparation Manufacturing;Photographic Film, Paper, Plate, and Chemical Manufacturing;Not Known or Reasonably Ascertainable
1-Butanaminium, N,N,N-tributyl-, hydroxide (1:1): ACTIVE
Anwendungen
VerwendenTetrabutylammonium hydroxide(TBAOH) is a quaternary ammonium salt mainly used as a strong base and phase-transfer catalyst. TBAOH may be used as an ion-pairing reagent in mobile phase preparation for reverse phase ion-pair high performance liquid chromatography during chromium (III) and chromium (VI) determination.
Darstellung
synthetischeTetrabutylammonium hydroxide was prepared by the ion exchange between gel type strong basic anion exchange resin(OH-) and aqueous solution of tetrabutylammonium bromide.
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