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triethylcholine , CAS No.302-61-4

COA

Grade & Purity:

Moligand™

Cas Number: 302-61-4
PubChem CID: 80058

In stock

Item Number

T614535

Grouped product items
SKU	Size	Availability	Price	Qty
T614535-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$670.90
T614535-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,000.90

Basic Description

Synonyms	N,N,N-TRIETHYLCHOLINE \| DTXSID90952589 \| Triethyl (2-hydroxyethyl)ammonium chloride \| SCHEMBL476985 \| 9B2PFY5LLZ \| AMMONIUM, TRIETHYL(2-HYDROXYETHYL)- \| Q7841461 \| TRIETHYLCHOLINE CATION \| UNII-9B2PFY5LLZ \| Triethylcholine \| BDBM50366913 \| CHOLINE, TRIETH
Specifications & Purity	Moligand™
Grade	Moligand™

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Quaternary ammonium salts

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Quaternary ammonium salts
Intermediate Tree Nodes	Not available
Direct Parent	Tetraalkylammonium salts
Alternative Parents	1,2-aminoalcohols Primary alcohols Organopnictogen compounds Organic salts Hydrocarbon derivatives Organic cations
Molecular Framework	Aliphatic acyclic compounds
Substituents	Tetraalkylammonium salt - 1,2-aminoalcohol - Alkanolamine - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Primary alcohol - Organooxygen compound - Amine - Alcohol - Organic cation - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as tetraalkylammonium salts. These are organonitrogen compounds containing a quaternary ammonium substituted with four alkyl chains.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	triethyl(2-hydroxyethyl)azanium
INCHI	InChI=1S/C8H20NO/c1-4-9(5-2,6-3)7-8-10/h10H,4-8H2,1-3H3/q+1
InChIKey	GZBUMTPCIKCWFW-UHFFFAOYSA-N
Smiles	OCC[N+](CC)(CC)CC
Isomeric SMILES	CC[N+](CC)(CC)CCO
PubChem CID	80058

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	146.250 g/mol
XLogP3	0.700
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	5
Exact Mass	146.154 Da
Monoisotopic Mass	146.154 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	10
Formal Charge	1
Complexity	71.100
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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