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Vinburnine

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Name

Vinburnine

EINECS 225-490-5
CAS No. 4880-88-0 Density 1.34 g/cm3
PSA 25.24000 LogP 3.71250
Solubility N/A Melting Point 174-177 °C(lit.)
Formula C19H22N2O Boiling Point 441.9 °C at 760 mmHg
Molecular Weight 294.396 Flash Point 221 °C
Transport Information N/A Appearance White to slightly yellow crystalline powder
Safety 22-24/25 Risk Codes N/A
Molecular Structure Molecular Structure of 4880-88-0 ((-)-EBURNAMONINE) Hazard Symbols N/A
Synonyms

Vincamone(7CI,8CI);(-)-Eburnamonine;(-)-Vincamone;(-)-cis-Eburnamonine;(3a,16a)-Eburnamonine;16-Oxoeburnane;CH 846;Cervoxan;Eburnal Ritardo;Vinburnine;cis-Vincamone;l-Eburnamonine;

Article Data 40

Vinburnine Specification

The CAS register number of Eburnamenin-14(15H)-one,(3a,16a)- is 4880-88-0. It also can be called as l-Eburnamonine and the systematic name about this chemical is (3α,16α)-14,15-dihydroeburnamenin-14-one. The molecular formula about this chemical is C19H22N2O and the molecular weight is 294.39. It belongs to the following product categories which include Alkaloids; Complex Molecules; Asymmetric Synthesis; Chiral Building Blocks and so on.

Physical properties about Eburnamenin-14(15H)-one,(3a,16a)- are: (1)ACD/LogP: 3.79; (2)ACD/LogD (pH 5.5): 1.27; (3)ACD/LogD (pH 7.4): 2.97; (4)ACD/BCF (pH 5.5): 1.36; (5)ACD/BCF (pH 7.4): 68.52; (6)ACD/KOC (pH 5.5): 8.4; (7)ACD/KOC (pH 7.4): 421.86; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 25.24 Å2; (11)Index of Refraction: 1.718; (12)Molar Refractivity: 86.47 cm3; (13)Molar Volume: 219.2 cm3; (14)Polarizability: 34.28x10-24cm3; (15)Surface Tension: 54.3 dyne/cm; (16)Density: 1.34 g/cm3; (17)Flash Point: 221 °C; (18)Enthalpy of Vaporization: 69.93 kJ/mol; (19)Boiling Point: 441.9 °C at 760 mmHg; (20)Vapour Pressure: 5.25E-08 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
 When you are using this chemical, do not breathe dust and avoid contact with skin and eyes. It is stable under normal temperature and pressure. If you want to store it, avoid contact with strong oxidant and keep the container tightly sealed in dry, cool places.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C5n1c3c(c2ccccc12)CCN4[C@H]3[C@](CCC4)(CC)C5
(2)InChI: InChI=1/C19H22N2O/c1-2-19-9-5-10-20-11-8-14-13-6-3-4-7-15(13)21(16(22)12-19)17(14)18(19)20/h3-4,6-7,18H,2,5,8-12H2,1H3/t18-,19+/m1/s1
(3)InChIKey: WYJAPUKIYAZSEM-MOPGFXCFBD
(4)Std. InChI: InChI=1S/C19H22N2O/c1-2-19-9-5-10-20-11-8-14-13-6-3-4-7-15(13)21(16(22)12-19)17(14)18(19)20/h3-4,6-7,18H,2,5,8-12H2,1H3/t18-,19+/m1/s1
(5)Std. InChIKey: WYJAPUKIYAZSEM-MOPGFXCFSA-N

The toxicity data are as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 265mg/kg (265mg/kg) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS
Medicamentos de Actualidad. Vol. 14, Pg. 160, 1978.
mouse LD50 intravenous 28mg/kg (28mg/kg) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Medicamentos de Actualidad. Vol. 14, Pg. 160, 1978.
mouse LD50 oral 3gm/kg (3000mg/kg)   United States Patent Document. Vol. #3852453,

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