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Dihexylamine acetate solution - 0.5088 mol/L , CAS No.366793-17-1

Dihexylamine acetate solution - 0.5088 mol/L , CAS No.366793-17-1

CAS: 366793-17-1 Cat. No.: D332030 Molecular Weight: 245.4 EC Number: 662-915-7

COA

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Dihexylamine acetate solution - 0.5088 mol/L CAS No(366793-17-1) by Aladdin Scientific

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AVAILABLE TO ORDER

GRADE & PURITY 0.5088 mol/L

Synonyms

Storage

Room temperature

Shipped In

Normal

Overview Specifications Names and Identifiers Documentation Advanced Data Taxonomic Classification 3D Structure Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solution Calculators Reviews

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Why this grade

0.5088 mol/L for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Dihexylamine acetate solution contains an ion pair reagent for HPLC/MS.

Specifications

Synonyms

Specifications & Purity

0.5088 mol/L

Storage

Room temperature

Shipped In

Normal

Note

1. Holcapek, M., et al., 2001. High performance liquid chromatography-mass spectrometric analysis of sulphonated dyes and intermediates. Journal of chromatography. A. 926(1): 175-86. PMID: 11554410

Names and Identifiers

Canonical Smiles	CCCCCCNCCCCCC.CC(=O)O
IUPAC Name	acetic acid;N-hexylhexan-1-amine
InChIKey	VAMSKEFYAOCCKM-UHFFFAOYSA-N
INCHI	1S/C12H27N.C2H4O2/c1-3-5-7-9-11-13-12-10-8-6-4-2;1-2(3)4/h13H,3-12H2,1-2H3;1H3,(H,3,4)
Isomeric SMILES	CCCCCCNCCCCCC.CC(=O)O
Molecular Weight	245.4
Reaxy-Rn	30706071
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=30706071&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

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	Quaternary ammonium salts
Alternative Parents	Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework	Not available
Substituents	Quaternary ammonium salt - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Amine - Organic cation - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as quaternary ammonium salts. These are compounds containing positively charged polyatomic ion of the structure NR4+, R being an alkyl group or an aryl group.
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

3D Structure

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	245.400 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	10
Exact Mass	245.235 Da
Monoisotopic Mass	245.235 Da
Topological Polar Surface Area	49.300 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	102.000
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	2

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Reviews

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