134-63-4
Product Name:
alpha-Lobeline hydrochloride
Formula:
C22H28ClNO2
Synonyms:
α-Lobeline hydrochloride;(−)-Lobeline hydrochloride;L -Lobeline hydrochloride
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CHEMICAL AND PHYSICAL PROPERTIES
Color/Form | ROSETTES OF SLENDER NEEDLES FROM ALC |
---|---|
Melting Point | 178-180 °C |
Solubility | 1 G DISSOLVES IN 40 ML WATER, 12 ML ALC; VERY SOL IN CHLOROFORM |
Optical Rotation | SPECIFIC OPTICAL ROTATION: -43 DEG @ 20 °C/D (2%) |
pH | WATER SOLN ARE SLIGHTLY ACID TO LITMUS |
Collision Cross Section | 186 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards] |
SAFETY INFORMATION
Signal word | Danger |
---|---|
Pictogram(s) |
Skull and Crossbones Acute Toxicity GHS06 |
COMPUTED DESCRIPTORS
Molecular Weight | 373.9 g/mol |
---|---|
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 6 |
Exact Mass | 373.1808568 g/mol |
Monoisotopic Mass | 373.1808568 g/mol |
Topological Polar Surface Area | 40.5 Ų |
Heavy Atom Count | 26 |
Formal Charge | 0 |
Complexity | 412 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 3 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 2 |
Compound Is Canonicalized | Yes |