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Key Documents

C70509

Sigma-Aldrich

4-Chloroquinoline

99%

Synonym(s):

4-Chloroquinoline

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About This Item

Empirical Formula (Hill Notation):
C9H6ClN
CAS Number:
Molecular Weight:
163.60
Beilstein:
114721
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

99%

form

liquid

bp

260-261 °C (lit.)

mp

28-31 °C (lit.)

density

1.25 g/mL at 20 °C (lit.)

SMILES string

Clc1ccnc2ccccc12

InChI

1S/C9H6ClN/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-6H

InChI key

KNDOFJFSHZCKGT-UHFFFAOYSA-N

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Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

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

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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Tamara Rodríguez-Cabo et al.
Analytical and bioanalytical chemistry, 407(20), 6159-6170 (2015-06-05)
Time-of-flight accurate mass spectrometry (TOF-MS), following a previous chromatographic (gas or liquid chromatography) separation step, is applied to the identification and structural elucidation of quinoline-like alkaloids in honey. Both electron ionization (EI) MS and positive electrospray (ESI+) MS spectra afforded

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