- 54844-65-46-Heneicosen-11-one,(6Z)-
- 54845-95-35,8,11,13-Eicosatetraenoicacid, 15-hydroxy-, (5Z,8Z,11Z,13E,15S)-
- 548460-64-6Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-,(1,3,4,5,6,7-hexahydro-1,3-dioxo-2H-isoindol-2-yl)methyl ester, (1R)-
- 548472-47-5Benzonitrile,4-methoxy-2-(1-methylethoxy)-
- 54847-94-8Liv 52
- 54-85-34-Pyridinecarboxylicacid, hydrazide
- 54856-23-4Betahistine mesylate
- 54856-60-92-Amino-4-methyl-3-pyridinecarboxaldehyde
- 54856-82-5[1,2,3]Triazolo[1,5-a]pyridine,3-methyl-
- 54856-83-6N,N,3,3-tetramethylazirin-2-amine
Hot Products
- 104987-11-3Tacrolimus
- 141-53-7Sodium formate
- 8001-54-5Quaternary ammonium compounds, alkylbenzyldimethyl, chlorides
- 9003-39-8Povidone
- 10161-34-9Trenbolone acetate
- 402957-28-2Telaprevir
- 68-19-9Cyanocobalamin
- 7631-86-9Silicon dioxide
- 302-79-4Tretinoin
- 77-92-9Citric acid
|
Basic Information |
|
Post buying leads |
|
Suppliers |
|
Cas Database |
| Name |
Agroclavine |
EINECS | N/A |
| CAS No. | 548-42-5 | Density | 1.161g/cm3 |
| PSA | 19.03000 | LogP | 3.00580 |
| Solubility | N/A | Melting Point |
198-208℃ (decomposition) (ethyl ether ) |
| Formula | C16H18 N2 | Boiling Point | 422.5°Cat760mmHg |
| Molecular Weight | 238.332 | Flash Point | 209.3°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by intraperitoneal route. Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Agroclavine(6CI); Indolo[4,3-fg]quinoline, ergoline deriv.; (-)-Agroclavine;8,9-Didehydro-6,8-dimethylergoline; Agroclavin; NSC 93132 |
Article Data | 18 |
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 .
What can I do for you?
Get Best Price
