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Hexetidine, mixture of stereoisomers

CAS 141-94-6C21H45N3Chemical Synthesis

Hexetidine, a mixture of stereoisomers (CAS: 141-94-6), is a chemical compound with a molecular weight of 339.60 g/mol. It is soluble in various organic solvents like acetone, ethanol, and chloroform, but insoluble in water. Primarily utilised in research settings, Hexetidine has been involved in studies concerning drug development, protein purification, and the inhibition of angiogenesis. Its properties make it a valuable reagent in chemical synthesis and heterocyclic chemistry.

IUPAC
5-Amino-1,3-bis(2-ethylhexyl)hexahydro-5-methylpyrimidine,NSC 17764
Synonyms
5-Amino-1,3-bis(2-ethylhexyl)hexahydro-5-methylpyrimidine, NSC 17764
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Hexetidine, mixture of stereoisomers (C21H45N3) — chemical structure, CAS 141-94-6; Chemistry, fine chemical supplied by Tech Serve Solutions
Building BlocksC12 to C30+Chemical SynthesisHeterocyclic Building BlocksPyrimidines
01 /Applications

Drug Efficacy Studies

Hexetidine has been investigated for its role in identifying pure liquid salt forms of aspirin and in screening antimalarial drugs. It has also been used in models for testing drugs against non-replicating Mycobacterium tuberculosis.

Biochemical Research

The compound is involved in studies of alkyl-based selective displacers for protein purification via ion exchange chromatography. Further research explores nutrient-sensitized screening for drugs that alter cellular energy metabolism.

Angiogenesis Inhibition Research

Hexetidine has been employed in scientific investigations focusing on the inhibition of angiogenesis, a critical process in various biological and pathological contexts.

Chemical Synthesis Reagent

As a heterocyclic building block, Hexetidine serves as a reagent in chemical synthesis, contributing to the development of novel compounds and materials.

02 /Properties
Molecular weight339.60
Empirical formulaC21H45N3
Boiling point160 °C/0.4 mmHg(lit.)
Density0.889 g/mL at 25 °C(lit.)
Refractive indexn20/D 1.4649(lit.)
Solubilityacetone: soluble(lit.)benzene: soluble(lit.)chloroform: soluble(lit.)ethanol: soluble(lit.)hexane: soluble(lit.)methanol: soluble(lit.)petroleum ether: soluble(lit.)water: insoluble(lit.)
ApplicationInvolved in studies:• To identify pure liquid salt forms of aspirin1• Of alkyl based selective displacers for protein purification via ion exchange chromatography2• Of the in vivo application of models for testing drugs against nonreplicating Mycobacterium tuberculosis 3• Nutrient-sensitized screening for drugs that shift the energy metabolism from mitochondrial respiration to glycolysis4• Inhibition of angiogensis5• Screening antimalarial drugs6
03 /Safety & handling
GHS hazard pictogram: Harmful / irritant (GHS07)
Harmful / irritant
Warning

Hazard statements

  • H315Causes skin irritation
  • H319Causes serious eye irritation
  • H335May cause respiratory irritation

Precautionary statements

  • P261Avoid breathing dust, fume, gas or vapours
  • P305IF IN EYES
Protective equipmentEyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Flash point70 °C / 158 °F
Transport (UN / ADR)NA 1993 / PGIII
Water hazard class (WGK, DE)3
Hazard codes (EU)Xi
Risk statements (R)36/37/38
Safety statements (S)26-36

Hazard information is provided for guidance. Always consult the product Safety Data Sheet (SDS), available on request, before handling.

04 /Identifiers & registry
CAS number
141-94-6
MDL number
MFCD00010428
PubChem substance
24855691
05 /Quality & supply

Documentation

Every batch ships with a Certificate of Analysis covering assay, identity and purity; the grade is confirmed against your enquiry. Safety Data Sheets and technical data sheets are available on request.

Supply & logistics

Samples for technical evaluation; bulk MOQ by grade and packaging. In-stock material ships in 7–10 working days, worldwide, with full export documentation.

06 /Frequently asked questions

What is Hexetidine mixture of stereoisomers used for?

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Hexetidine (CAS: 141-94-6) is primarily used in research settings, including studies on drug development, protein purification, angiogenesis inhibition, and as a heterocyclic building block in chemical synthesis.

What is the CAS number and formula for Hexetidine?

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The CAS number for Hexetidine, mixture of stereoisomers, is 141-94-6. The empirical formula is C21H45N3.

What grade and purity does Tech Serve Solutions supply for Hexetidine?

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Tech Serve Solutions supplies Hexetidine, mixture of stereoisomers, as a reagent for laboratory and research use. The specific purity and grade are detailed in the product specifications; we do not represent this product as USP, BP, or EP grade.

How should Hexetidine be handled safely?

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Hexetidine is classified as a Warning hazard. It can cause skin irritation (H315), serious eye irritation (H319), and may cause respiratory irritation (H335). Appropriate personal protective equipment, including eyeshields, gloves, and a suitable respirator, should be used. Refer to the safety data sheet for comprehensive handling instructions.

Is Hexetidine a controlled substance?

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Based on the provided data, Hexetidine is not indicated as a controlled substance.

How is Hexetidine packed and exported?

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Hexetidine is packed according to industry standards for chemical reagents and exported globally by Tech Serve Solutions. Specific packaging details are available upon request.

How can I request a sample or quote for Hexetidine?

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To request a sample or a quote for Hexetidine, please contact the Tech Serve Solutions sales team through our website or direct contact information, specifying the CAS number 141-94-6.

Need Hexetidine, mixture of stereoisomers in a specific grade or volume?