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329177

Sigma-Aldrich

(S)-(−)-(3-Chloro-2-hydroxypropyl)trimethylammonium chloride

99%

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About This Item

Linear Formula:
ClCH2CH(OH)CH2N(CH3)3Cl
CAS Number:
101396-91-2
Molecular Weight:
188.10
MDL number:
MFCD00074882
UNSPSC Code:
12352101
PubChem Substance ID:
24859774
NACRES:
NA.22

Quality Level

100

assay

99%

optical activity

[α]25/D −29°, c = 1 in H2O

mp

210 °C (dec.) (lit.)

functional group

amine
chloro
hydroxyl

SMILES string

[Cl-].C[N+](C)(C)C[C@H](O)CCl

InChI

1S/C6H15ClNO.ClH/c1-8(2,3)5-6(9)4-7;/h6,9H,4-5H2,1-3H3;1H/q+1;/p-1/t6-;/m1./s1

InChI key

CSPHGSFZFWKVDL-FYZOBXCZSA-M

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
07111LX
03005KT

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Alison E Dowey et al.
Chirality, 28(4), 299-305 (2016-02-18)
Cationic trialkylammonium-substituted α-, β-, and γ-cyclodextrins containing trimethyl-, triethyl-, and tri-n-propylammonium substituent groups were synthesized and analyzed for utility as water-soluble chiral nuclear magnetic resonance (NMR) solvating agents. Racemic and enantiomerically pure (3-chloro-2-hydroxypropyl)trimethyl-, triethyl-, and tri-n-propyl ammonium chloride were synthesized

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