(8alpha,9R)-Cinchonan-9-ol | CAS No. 485-71-2

(8alpha,9R)-Cinchonan-9-ol

Basic Information

CAS Number

485-71-2

Molecular Formula

C19H22N2O

Molecular Weight

294.4 g/mol

AD

Basic Physical Properties

Melting Point

204-206 ºC

Boiling Point

464.5°C at 760 mmHg

Flash Point

234.7 °C

Solubility

0.25g/l

Refractive Index

-107.5 ° (C=1, EtOH)

Specific Rotation

-115 º (c=1, EtOH)

O[C@@H]([C@@H]1C[C@@H]2CCN1C[C@@H]2C=C)c3ccnc4ccccc34

InChI

InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13-,14-,18-,19+/m0/s1

InChIKey

KMPWYEUPVWOPIM-KODHJQJWSA-N

LogP

3.164600000000002

pKa

5.80, 10.03(at 25℃)

Topological Polar Surface Area

36.36 Ų

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

412

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Hazard Class

Class 6.1(b) Class 6.1(b)

Toxicity

LD50 i.p. in rats: 206 mg/kg (Johnson, Poe); LD50 orally in quail: >316 mg/kg (Schafer)

Synonyms & References

English

  • (8alpha,9r)-cinchonan-9-ol
  • ALPHA-QUINIDINE
  • A-QUINIDINE
  • CINCHONAN-9-OL,(8,9R)-
  • (-)-CINCHONIDINE
  • CINCHONIDINE
  • L-CINCHONIDINE
  • (8-alpha,9r)-cinchonan-9-o
  • (8alpha,9theta)-cinchonan-9-o
  • (8s,9r)-cinchonidine
  • 2-Quinuclidinemethanol, alpha-4-quinolyl-5-vinyl-
  • Cinchonan-9-ol
  • Cinchonan-9-ol, (8alpha,9R)-
  • Cinchovatine
  • CINCHONIDINE: CINCHONAN-9-OL,(8,9R)-,
  • [8α,9R]-Cinchonan-9-ol
  • CINCHONIDINE(RG)
  • Cinchonan-9-ol, (8α,9R)-
  • (+)-cinchonine
  • 1-Cinchonidine
  • chinchonidine
  • Cinchondine
  • 4-Quinolyl-(5-vinyl-1-azabicyclo[2.2.2]oct-2-yl)methanol
  • (8S,9R)-cinchonan-9-ol
  • 1U622LRA8Z
  • Cinchonan-9-ol, (8a,9R)-
  • (8-alpha,9R)-Cinchonan-9-ol
  • Cinchonan-9-ol, (8.alpha.,9R)-
  • (8alpha,9R)Cinchonan-9-ol
  • (R)-[(4S,5S,7S)-5-ethenyl-1-azabicyclo[2.2.2]octan-7-yl]-quinolin-4-ylmethanol
  • AI3-1

MDL Number

MFCD00006783

Customs Code

2939200000

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