Welcome to LookChem.com Sign In|Join Free

Product Name

  • or
Home > Products > 

Agroclavine
Basic Information Post buying leads Suppliers Cas Database
Basic InformationSuppliers
  • Name Agroclavine
  • EINECSN/A
  • CAS No. 548-42-5
  • Density1.161g/cm3
  • PSA19.03000
  • LogP3.00580
  • SolubilityN/A
  • Melting Point198-208℃ (decomposition) (ethyl ether )
  • FormulaC16H18 N2
  • Boiling Point422.5°Cat760mmHg
  • Molecular Weight238.332
  • Flash Point209.3°C
  • Transport InformationN/A
  • AppearanceN/A
  • SafetyPoison by intraperitoneal route. Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 548-42-5 (AGROCLAVINE)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data18

Agroclavine Chemical Properties

Molecular Formula: C16H18N2
Molar mass of Agroclavine (548-42-5): 238.3275 g/mol
EINECS: 208-947-3
Density: 1.161 g/cm3
Flash Point: 209.3 °C
Index of Refraction: 1.653
Boiling Point: 422.5 °C at 760 mmHg
Vapour Pressure: 2.4E-07 mmHg at 25°C
Structure of Agroclavine (548-42-5):
 
XLogP3-AA: 2.6
H-Bond Donor: 1
H-Bond Acceptor: 1
SMILES: c2c3c1c(cccc1n2)[C@H]4\C=C(/CN([C@@H]4C3)C)C 
InChI: InChI=1/C16H18N2/c1-10-6-13-12-4-3-5-14-16(12)11(8-17-14)7-15(13)18(2)9-10/h3-6,8,13,15,17H,7,9H2,1-2H3/t13-,15-/m1/s1 
InChIKey: XJOOMMHNYOJWCZ-UKRRQHHQBY 
Std. InChI: InChI=1S/C16H18N2/c1-10-6-13-12-4-3-5-14-16(12)11(8-17-14)7-15(13)18(2)9-10/h3-6,8,13,15,17H,7,9H2,1-2H3/t13-,15-/m1/s1 
Std. InChIKey: XJOOMMHNYOJWCZ-UKRRQHHQSA-N

Agroclavine Toxicity Data With Reference

1.    

mmo-sat 2 µmol/plate

     CNREA8    Cancer Research. 47 (1987),1811.
2.    

ipr-mus LD50:25 mg/kg

     ARZNAD    Arzneimittel-Forschung. Drug Research. 35 (1985),1760.
3.    

ivn-mus LD50:25,500 µg/kg

     NYKZAU    Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. 58 (1962),386.

Agroclavine Safety Profile

Poison by intraperitoneal route. Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx.

Agroclavine Specification

 Agroclavine (548-42-5) also can be called 6,8-Dimethyl-8,9-didehydroergoline ; Ergoline, 8,9-didehydro-6,8-dimethyl- ; Indolo(4,3-fg)quinoline, 4,6,6a,7,8,10a-hexahydro-7,9-dimethyl- and Agroclavine-1 .

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 548-42-5
Related Products

Hot Products

Post a RFQ