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Key Documents

40767

Sigma-Aldrich

(4S,5S)-(+)-2,2-Dimethyl-5-methylamino-4-phenyl-1,3-dioxane

≥98.0% (sum of enantiomers, GC)

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About This Item

Empirical Formula (Hill Notation):
C13H19NO2
CAS Number:
Molecular Weight:
221.30
Beilstein/REAXYS Number:
3591157
MDL number:
UNSPSC Code:
12352005
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

≥98.0% (sum of enantiomers, GC)

optical activity

[α]20/D +43±2°, c = 1.5% in toluene

storage temp.

2-8°C

SMILES string

CN[C@H]1COC(C)(C)O[C@H]1c2ccccc2

InChI

1S/C13H19NO2/c1-13(2)15-9-11(14-3)12(16-13)10-7-5-4-6-8-10/h4-8,11-12,14H,9H2,1-3H3/t11-,12-/m0/s1

InChI key

OLDLOVICBLVDFQ-RYUDHWBXSA-N

Packaging

Bottomless glass bottle. Contents are inside inserted fused cone.

Other Notes

Chiral auxiliary for the enantioselective synthesis of 4-keto esters

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter


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D. Enders et al.
Synthesis, 659-659 (1995)

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