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Brucine hydrate

ALDRICH/367869 - technical grade

CAS Number: 5892-11-5
Empirical Formula (Hill Notation): C23H26N2O4 · xH2O
Molecular Weight: 394.46 (anhydrous basis)
EC Number: 206-614-7
MDL Number: MFCD00149385
Linear Formula: C23H26N2O4 · xH2O
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-367869-100G 100 g
 $543.00
1/EA		 Add To Favorites
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 367869-100G

 

form solid
grade technical grade
InChI 1S/C23H26N2O4.H2O/c1-27-16-8-14-15(9-17(16)28-2)25-20(26)10-18-21-13-7-19-23(14,22(21)25)4-5-24(19)11-12(13)3-6-29-18;/h3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3;1H2/t13-,18-,19-,21-,22-,23+;/m0./s1
InChI key IEJIBKWJYHZFNW-SUJBTXFYSA-N
mp 177-180 °C (lit.)
optical activity [α]20/D −67°, c = 1.3 in ethanol
SMILES string [H]O[H].[H][C@@]12CC(=O)N3c4cc(OC)c(OC)cc4[C@]56CC[N@H]7CC(=CCO1)[C@]([H])(C[C@@H]57)[C@]2([H])[C@]36[H]
Packaging: 100 g in glass bottle
mp 177-180 °C (lit.)
UNSPSC 12352005

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