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737666

(S,S)-cis EZ-CrotylMix™

Synonym(s):

(25:1)-(3aS,7aS)-1,3-Bis(4-bromobenzyl)-2-((Z)-but-2-enyl)-2-chlorooctahydro-1H-benzo[d][1,3,2]diazasilole:scandium(III) triflate

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About This Item

Empirical Formula (Hill Notation):
C27H29Br2ClF9N2O9S3ScSi
Molecular Weight:
1061.01
PubChem Substance ID:
329765218
UNSPSC Code:
12352103
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form

powder

Quality Level

100

SMILES string

FC(F)(F)S(=O)(=O)O[Sc](OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F.C\C=C/C[Si]1(Cl)N(Cc2ccc(Br)cc2)[C@H]3CCCC[C@@H]3N1Cc4ccc(Br)cc4

InChI

1S/C24H29Br2ClN2Si.3CHF3O3S.Sc/c1-2-3-16-30(27)28(17-19-8-12-21(25)13-9-19)23-6-4-5-7-24(23)29(30)18-20-10-14-22(26)15-11-20;3*2-1(3,4)8(5,6)7;/h2-3,8-15,23-24H,4-7,16-18H2,1H3;3*(H,5,6,7);/q;;;;+3/p-3/b3-2-;;;;/t23-,24-;;;;/m0..../s1

InChI key

PRMHXJZNOJQQCI-QGJQGQTRSA-K

Application

EZ-CrotylMix: A Comprehensive Solution to the Enantioselective Crotylation of Aldehydes

Legal Information

EZ-CrotylMix is a trademark of Columbia University

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

13 - Non Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
SHBB0084

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