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461-05-2

461-05-2 structural image
Product Name: DL-Carnitine hydrochloride
Formula: C7H16ClNO3
Synonyms: DL-Carnitine hydrochloride;Vitamin BT;β-Hydroxy-γ-(trimethylammonio)butyrate hydrochloride;(?)-(R)-3-Hydroxy-4-(trimethylammonio)butyrate;(±)-Carnitine chloride
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >29.6 [ug/mL] (The mean of the results at pH 7.4)
Collision Cross Section 132.9 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405:Store locked up.

COMPUTED DESCRIPTORS

Molecular Weight 197.66 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 197.0818711 g/mol
Monoisotopic Mass 197.0818711 g/mol
Topological Polar Surface Area 57.5 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 139
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

A constituent of STRIATED MUSCLE and LIVER. It is an amino acid derivative and an essential cofactor for fatty acid metabolism.