BRUCINE

Inquiry

For Research Use Only.

Category

Alkaloids

Cat.No.

NP0370

CAS

5892-11-5

Product Name

BRUCINE

Structure

Product Details

Synonyms

STRYCHNIDIN-10-ONE,2,3-DIMETHOXY; 2,3-DIMETHOXYSTRYCHNIDIN-10-ONE; BRUCINE TETRAHYDRATE; BRUCINE ALKALOID; BRUCINE HYDRATE, TECH.; Strychnidin-10-one, 2,3-dimethoxy-, tetrahydrate; BURCINETETRAHYDRATE

IUPAC Name

(4aR,5aS,8aR,13aS,15aS,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one

Molecular Weight

394.46

Molecular Formula

C23H26N2O4

Canonical SMILES

COC1=C(C=C2C(=C1)C34CCN5C3CC6C7C4N2C(=O)CC7OCC=C6C5)OC

InChI

1/C24H27NO4.2H2O/c1-27-17-7-14-15(9-18(17)28-2)24-4-5-25-11-12-3-6-29-19-10-16(26)21(14)23(24)22(19)13(12)8-20(24)25;;/h3,7,9,13,19-23H,4-6,8,10-11H2,1-2H3;2*1H2/t13?,19-,20?,21?,22-,23-,24+;;/m0../s1

InChIKey

VWLBJWIPYIYRBM-FIMIILAWSA-N

Boiling Point

689.9°C at 760 mmHg

Melting Point

175-178 °C (dec.)(lit.)

Flash Point

371°C

Purity

0.99

Solubility

Soluble in methanol.

EINECS

628-126-7

Form

Powder

Hazard Class

6.1

Hazard Codes

T+

Packing Groups

RIDADR

UN 1570 6.1/PG 1

Risk Statements

26/28-52/53-36/37/38-26/27/28

RTECS

EH8925000

Safety Statements

13-45-61-36/37-28

Uses

Brucine dihydrate is used as a resolving agent for chiral acids.

Water Solubility

Partially soluble Miscible with water.

WGK Germany

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