Lysergic acid supplier | CasNO.82-58-6

This product is a nationally controlled contraband, and the Lookchem platform doesn't provide relevant sales information.

Name
9,10-DIDEHYDRO-6-METHYL-ERGOLINE-8-CARBOXYLIC ACID
EINECS 201-431-9
CAS No. 82-58-6
Article Data19
CAS DataBase
Density 1.39 g/cm³
Solubility 267mg/L at 20℃
Melting Point >170°C (dec.)
Formula C₁₆H₁₆N₂O₂
Boiling Point 536.2 °C at 760 mmHg
Molecular Weight 268.315
Flash Point 278.1 °C
Transport Information
Appearance beige to brown powder
Safety
Risk Codes Xn:Harmful;
Molecular Structure
Hazard Symbols R40:Possible risks of irreversible effects.;
Synonyms Ergoline-8b-carboxylic acid,9,10-didehydro-6-methyl- (8CI);Lysergic acid (6CI);(+)-Lysergic acid;D(+)-Lysergic acid;D-Lysergic acid;Lysergic acid;
PSA 56.33000
LogP 2.06010

Lysergic acid Specification

The CAS registry number of Lysergic acid is 82-58-6. Its EINECS registry number is 201-431-9. The systematic name is (8β)-6-methyl-9,10-didehydroergoline-8-carboxylic acid. In addition, the molecular formula is C₁₆H₁₆N₂O₂ and the molecular weight is 268.31. It is also called Ergoline-8-carboxylicacid,9,10-didehydro-6-methyl-,(8b)-. What's more, it is a precursor for a wide range of ergoline alkaloids that are produced by the ergot fungus and some plants. It is usually produced by hydrolysis of lysergamides, but can also be synthesized in the laboratory by a complex total synthesis.

Physical properties about Lysergic acid are:
(1)ACD/LogP: 2.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.36; (4)ACD/LogD (pH 7.4): -0.37; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.09; (8)ACD/KOC (pH 7.4): 1.08; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 34.47 Å²; (13)Index of Refraction: 1.725; (14)Molar Refractivity: 76.35 cm³; (15)Molar Volume: 192.1 cm³; (16)Polarizability: 30.26×10^-24cm³; (17)Surface Tension: 71.1 dyne/cm; (18)Density: 1.39 g/cm³; (19)Flash Point: 278.1 °C; (20)Enthalpy of Vaporization: 85.55 kJ/mol; (21)Boiling Point: 536.2 °C at 760 mmHg; (22)Vapour Pressure: 2.51E-12 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H]3/C=C2/c4cccc1c4c(cn1)C[C@H]2N(C3)C
(2)InChI: InChI=1/C16H16N2O2/c1-18-8-10(16(19)20)5-12-11-3-2-4-13-15(11)9(7-17-13)6-14(12)18/h2-5,7,10,14,17H,6,8H2,1H3,(H,19,20)/t10-,14-/m1/s1
(3)InChIKey: ZAGRKAFMISFKIO-QMTHXVAHBD

Product Name

9,10-DIDEHYDRO-6-METHYL-ERGOLINE-8-CARBOXYLIC ACID

Lysergic acid Specification

Related Products

Hot Products