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W297607

Sigma-Aldrich

Quinine monohydrochloride dihydrate

≥95%, FG

Synonym(s):
Quinine monohydrochloride dihydrate, Quinine hydrochloride dihydrate
Empirical Formula (Hill Notation):
C20H24N2O2 · HCl · 2H2O
CAS Number:
Molecular Weight:
396.91
FEMA Number:
2976
Beilstein:
6112655
EC Number:
Council of Europe no.:
715
MDL number:
PubChem Substance ID:
Flavis number:
14.155
NACRES:
NA.21

biological source

synthetic

Quality Level

grade

FG
Halal
Kosher

reg. compliance

EU Regulation 1334/2008 & 872/2012

Assay

≥95%

optical activity

[α]22/D −235°, c = 2 in 0.1 M HCl

mp

115-116 °C (dec.) (lit.)
115-116 °C (dec.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

Organoleptic

odorless

SMILES string

Cl[H].[H]O[H].[H]O[H].[H][C@@]12CCN(C[C@@H]1C=C)[C@@]([H])(C2)[C@H](O)c3ccnc4ccc(OC)cc34

InChI

1S/C20H24N2O2.ClH.2H2O/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;;;/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;1H;2*1H2/t13-,14-,19-,20+;;;/m0.../s1

Inchi Key

MPQKYZPYCSTMEI-FLZPLBAKSA-N

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This Item
145920226321596807
biological source

synthetic

biological source

-

biological source

-

biological source

-

grade

FG, Halal, Kosher

grade

-

grade

-

grade

pharmaceutical primary standard

assay

≥95%

assay

90%

assay

-

assay

-

optical activity

[α]22/D −235°, c = 2 in 0.1 M HCl

optical activity

[α]20/D −144°, c = 1 in H2O

optical activity

-

optical activity

-

mp

115-116 °C (dec.) (lit.)

mp

115-116 °C (dec.) (lit.)

mp

-

mp

-

documentation

see Safety & Documentation for available documents

documentation

-

documentation

-

documentation

-

Pictograms

Exclamation markHealth hazard

Signal Word

Danger

Hazard Statements

Hazard Classifications

Acute Tox. 4 Oral - Resp. Sens. 1 - Skin Sens. 1

Storage Class Code

11 - Combustible Solids

WGK

WGK 1

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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