(2R)-2-Acetoxy-3-carboxy-N,N,N-trimethyl-1-propanaminium chloride

Basic Information

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CAS Number

5080-50-2

Molecular Formula

C9H18ClNO4

Molecular Weight

239.69 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Melting Point

194 ºC

Boiling Point

°Cat760mmHg

Solubility

H2O: 100 mg/mL

Refractive Index

-28 ° (C=1, H2O)

Specific Rotation

-29 º (c=1, H2O)

SMILES

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CC(=O)OC(CC(=O)O)C[N+](C)(C)C.[Cl-]

InChI

InChI=1S/C9H17NO4.ClH/c1-7(11)14-8(5-9(12)13)6-10(2,3)4;/h8H,5-6H2,1-4H3;1H/t8-;/m1./s1

InChIKey

JATPLOXBFFRHDN-DDWIOCJRSA-N

LogP

0.90100

Complexity

219

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Sensitiveness

Hygroscopic

Synonyms & References

English

5080-50-2
ACETYLCARNITINE HYDROCHLORIDE [WHO-DD]
ACETYL-L-CARNITINE CHLORIDE
Acetyl-L-carnitine Hydrochloride, >/=99%
Levacecarnine hydrochloride
AC-004
[(2R)-2-acetoxy-3-carboxy-propyl]-trimethyl-ammonium
AKOS015963427
o-Acetyl-L-carnitine hydrochloride
Acetylcarnitine L-form hydrochloride
AS-11664
O-Acetyl-L-carnitine hydrochloride, >=99% (titration), powder
MLS001332368
(R)-3-Acetoxy-4-(trimethylammonio)butyrate hydrochloride
O-acetylcarnitine
O-Acetyl-L-carnitine (hydrochloride)
Acetyl-L-carnitine hydrochloride
NSC 747431
NDW10MX58T
NSC747431
SMR000875234
Oristar ach
1-Propanaminium, 2-(acetyloxy)-3-carboxy-N,N,N-trimethyl-, chloride, (R)-
NSC-747431
1-PROPANAMINIUM, 2-(ACETYLOXY)-3-CARBOXY-N,N,N-TRIMETHYL-, CHLORIDE (1:1), (2R)-
ACETYL CARNITINE HCL
AKOS005138019
Normobren
UNII-NDW10MX58T
Branigen
ACETYLCARNITINE HYDROCHLORIDE [MART.]

MDL Number

MFCD00082230

FAQ

What is (2R)-2-Acetoxy-3-carboxy-N,N,N-trimethyl-1-propanaminium chloride (CAS: 5080-50-2)?

This compound is a quaternary ammonium salt with the molecular formula C9H18ClNO4. It features an acetoxy group at the 2-position, a carboxy group at the 3-position, and three methyl groups attached to the nitrogen atom. Known for its solubility in water and stability under normal conditions, it is commonly used in pharmaceutical and chemical research contexts.

What are the main uses of (2R)-2-Acetoxy-3-carboxy-N,N,N-trimethyl-1-propanaminium chloride (CAS: 5080-50-2)?

Primarily utilized in pharmaceutical applications, this compound serves as an intermediate in drug synthesis, particularly for antifungal and antiviral agents. It also finds use in chemical synthesis, as a buffer solution, and in research for developing new therapeutic compounds. Its unique structure makes it valuable in industrial and academic settings.

Is (2R)-2-Acetoxy-3-carboxy-N,N,N-trimethyl-1-propanaminium chloride (CAS: 5080-50-2) safe?

When handled properly, this compound is generally considered safe. However, it may cause skin or eye irritation, so protective gear like gloves and safety goggles is recommended. Safety standards emphasize avoiding inhalation and contact with skin. Always consult safety data sheets for specific handling guidelines.

How should (2R)-2-Acetoxy-3-carboxy-N,N,N-trimethyl-1-propanaminium chloride (CAS: 5080-50-2) be stored?

Store in a cool, dry place (2-8°C), protected from light. Use airtight containers to prevent moisture absorption. Ensure storage conditions maintain stability and avoid exposure to heat or humidity. Keep away from incompatible substances to ensure long-term preservation.