Lysergic acid | CAS No. 82-58-6

Basic Information

Lysergic acid

CAS Number

82-58-6

Molecular Formula

C16H16N2O2

Molecular Weight

268.31 g/mol

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Basic Physical Properties

Melting Point

>170°C (dec.)

Boiling Point

411.48°C (rough estimate)

Density

1.1028 (rough estimate)

Refractive Index

1.6240 (estimate)

Specific Rotation

D20 +40° (c = 0.5 in pyridine)

SMILES

CN1CC(C=C2C1CC3=CNC4=CC=CC2=C34)C(=O)O

InChI

InChI=1S/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

InChIKey

ZAGRKAFMISFKIO-QMTHXVAHSA-N

LogP

2.1222

pKa

3.44, 7.68(at 25℃)

Topological Polar Surface Area

56.33 Ų

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

461

Classification & Uses

Chemical Classification

Pharmaceutical Products
APIs & Intermediates
Intermediates

Safety Information

Synonyms & References

English

  • ITO20DAO7J
  • DEA No. 7300
  • EINECS 201-431-9
  • AKOS030240864
  • Ergoline-8-carboxylic acid, 9,10-didehydro-6-methyl-, (8beta)-
  • SCHEMBL183687
  • (+)-Lysergic acid
  • D-Lysergic acid
  • D0L9ZQ
  • LYSERGIC ACID [MI]
  • (8.BETA.)-9,10-DIDEHYDRO-6-METHYLERGOLINE-8-CARBOXYLIC ACID
  • LYSERGIC ACID
  • (8R)-9,10-didehydro-6-methylergoline-8-carboxylic acid
  • (8beta)-9,10-didehydro-6-methylergoline-8-carboxylic acid
  • CHEBI:6604
  • 82-58-6
  • Q415837
  • (8beta)-6-methyl-9,10-didehydroergoline-8-carboxylic acid
  • Ergoline Acid
  • PDSP2_000050
  • ERGOMETRINE MALEATE IMPURITY A [EP IMPURITY]
  • DTXSID60904515
  • ZAGRKAFMISFKIO-QMTHXVAHSA-N
  • UNII-ITO20DAO7J
  • Ergoline-8-carboxylic acid, 9,10-didehydro-6-methyl-, (8.beta.)-
  • (8-beta)-9,10-Didehydro-6-methylergoline-8-carboxylic acid
  • Lysergic acid
  • ***
  • 9,10-DIDEHYDRO-6-METHYL-ERGOLINE-8-CARBOXYLIC ACID
  • 9,10-Didehydro-6-methylergoline-8-carboxylic
  • D-LYSERGIC ACID HYDRATE
  • d-Lysergsaeure
  • Lysergic
  • LYSERGIC ACID(9,10-DIDEHYDRO-6-METHYLERGOLINE-8-CARBOXYLIC ACID)
  • Quinapril hydrochloride,(3S)-2-[(2S)-2-[[(1S)-1-(Ethoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid hydrochloride
  • Ergoline-8b-carboxylic acid,9,10-didehydro-6-methyl- (8CI)
  • Lysergic acid (6CI)
  • Indolo[4,3-fg]quinoline,ergoline-8-carboxylic acid deriv.
  • D(+)-Lysergic acid
  • d-Lysergic acid

CAS Number

82-58-6

Customs_Code

2939630010

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