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DL-Carnitine hydrochloride

CAT: 0862-GM8717-500gSize: 500 gDry Ice: NoHazardous: No
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CAT#:0862-GM8717-500gSize:500 g
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CAS Number
461-05-2
EC Number
207-309-1
MDL Number
MFCD00011904
HS Code
2923900090
Purity
98.50%
Molecular Formula
C7H15NO3 · HCl
Molecular Weight
197.66
Storage Conditions
+20°C
Hazardous Class
Not hazardous

Chemical Information

Carnitine Chloride
CAS Number461-05-2
PubChem CID5970
IUPAC Name(3-carboxy-2-hydroxypropyl)-trimethylazanium chloride
Molecular FormulaC7H16ClNO3
Molecular Weight197.66
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count12
Formal Charge0
Complexity139
SMILES
C[N+](C)(C)CC(CC(=O)O)O.[Cl-]
InChI
InChI=1S/C7H15NO3.ClH/c1-8(2,3)5-6(9)4-7(10)11;/h6,9H,4-5H2,1-3H3;1H
InChIKey
JXXCENBLGFBQJM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Carnitine Chloride
CAS: 461-05-2
CID: 5970
Formula: C7H16ClNO3
MW: 197.66
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight197.66
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass197.0818711
Monoisotopic Mass197.0818711
Topological Polar Surface Area57.5 Ų
Heavy Atom Count12
Formal Charge0
Complexity139
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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