Products Categories
CAS No.: | 90-39-1 |
---|---|
Name: | (-)-SPARTEINE |
Article Data: | 22 |
Molecular Structure: | |
Formula: | C15H26N2 |
Molecular Weight: | 234.385 |
Synonyms: | 7,14-Methano-2H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocine,dodecahydro-, [7S-(7a,7aa,14a,14ab)]-;Sparteine (6CI,8CI);(-)-Sparteine;6b,7a,9a,11a-Pachycarpine;Lupinidin;Lupinidine;Spartein;l-Sparteine;Sparteine; |
EINECS: | 201-988-8 |
Density: | 1.08 g/cm3 |
Melting Point: | 30.5°C |
Boiling Point: | 340.9 °C at 760 mmHg |
Flash Point: | 148.3 °C |
Solubility: | 3.04g/L(25 oC) |
Hazard Symbols: | Xn |
Risk Codes: | 20/21/22 |
Safety: | 36 |
PSA: | 6.48000 |
LogP: | 2.22090 |
The Sparteine is an organic compound with the formula C15H26N2. The systematic name of this chemical is sparteine. With the CAS registry number 90-39-1, it is also named as 7,14-Methano-2H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocine, dodecahydro-. The product's categories are Alkaloids; Alkaloids (Others); Biochemistry. Besides, it should be stored in a closed cool and dry place. It is used as a chiral base in organic chemistry, and as a ligand in organic synthesis.
Physical properties about Sparteine are: (1)ACD/LogP: 2.837; (2)ACD/LogD (pH 5.5): -1.22; (3)ACD/LogD (pH 7.4): -0.02; (4)ACD/BCF (pH 5.5): 1.00; (5)ACD/BCF (pH 7.4): 1.00; (6)ACD/KOC (pH 5.5): 1.00; (7)ACD/KOC (pH 7.4): 1.15; (8)#H bond acceptors: 2; (9)Index of Refraction: 1.57; (10)Molar Refractivity: 71.006 cm3; (11)Molar Volume: 216.361 cm3; (12)Polarizability: 28.149 10-24cm3; (13)Surface Tension: 44.0499992370605 dyne/cm; (14)Density: 1.083 g/cm3; (15)Flash Point: 148.344 °C; (16)Enthalpy of Vaporization: 58.449 kJ/mol; (17)Boiling Point: 340.892 °C at 760 mmHg
When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. When you are using it, wear suitable protective clothing.
You can still convert the following datas into molecular structure:
(1)InChI=1S/C15H26N2/c1-3-7-16-11-13-9-12(14(16)5-1)10-17-8-4-2-6-15(13)17/h12-15H,1-11H2/t12-,13-,14-,15+/m1/s1;
(2)InChIKey=SLRCCWJSBJZJBV-TUVASFSCSA-N;
(3)SmilesC1[C@H]2[C@H]3[N@@](C[C@@H]1[C@H]1CCCC[N@@]1C2)CCCC3
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
dog | LD50 | intravenous | 15mg/kg (15mg/kg) | Veterinary and Human Toxicology. Vol. 41, Pg. 33, 1999. | |
frog | LDLo | intramuscular | 1665mg/kg (1665mg/kg) | "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1398, 1935. | |
frog | LDLo | subcutaneous | 3330mg/kg (3330mg/kg) | "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1398, 1935. | |
guinea pig | LDLo | intraperitoneal | 23mg/kg (23mg/kg) | Journal of Agricultural Research Vol. 32, Pg. 51, 1926. | |
guinea pig | LDLo | intravenous | 27mg/kg (27mg/kg) | LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY) BEHAVIORAL: TREMOR | Planta Medica. Vol. 50, Pg. 420, 1984. |
mouse | LD50 | intraperitoneal | 36mg/kg (36mg/kg) | BEHAVIORAL: TREMOR BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY) LUNGS, THORAX, OR RESPIRATION: DYSPNEA | Planta Medica. Vol. 50, Pg. 420, 1984. |
mouse | LD50 | oral | 220mg/kg (220mg/kg) | LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY) BEHAVIORAL: TREMOR | Planta Medica. Vol. 50, Pg. 420, 1984. |
mouse | LD50 | subcutaneous | 105mg/kg (105mg/kg) | Pharmacology and Toxicology. English translation of FATOAO. Vol. 21, Pg. 468, 1958. | |
pigeon | LDLo | subcutaneous | 86mg/kg (86mg/kg) | "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1398, 1935. | |
rabbit | LDLo | intravenous | 30mg/kg (30mg/kg) | "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1398, 1935. | |
rabbit | LDLo | subcutaneous | 100mg/kg (100mg/kg) | "Structure et Activite Pharmacodyanmique des Medicaments du Systeme Nerveux Vegetatif," Bovet, D., and F. Bovet-Nitti, New York, S. Karger, 1948Vol. -, Pg. 589, 1948. | |
rat | LD50 | intraperitoneal | 42mg/kg (42mg/kg) | Compilation of LD50 Values of New Drugs. | |
rat | LD50 | oral | 960mg/kg (960mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 210, Pg. 27, 1974. |