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Key Documents

T15504

Sigma-Aldrich

1,2,3,4-Tetrahydroquinoline

98%

Synonym(s):

THQ

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About This Item

Empirical Formula (Hill Notation):
C9H11N
CAS Number:
Molecular Weight:
133.19
Beilstein:
116149
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

98%

refractive index

n20/D 1.593 (lit.)

bp

113-117 °C/10 mmHg (lit.)
249 °C (lit.)

mp

9-14 °C (lit.)

density

1.061 g/mL at 25 °C (lit.)

SMILES string

C1CNc2ccccc2C1

InChI

1S/C9H11N/c1-2-6-9-8(4-1)5-3-7-10-9/h1-2,4,6,10H,3,5,7H2

InChI key

LBUJPTNKIBCYBY-UHFFFAOYSA-N

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Pictograms

Skull and crossbonesHealth hazard

Signal Word

Danger

Hazard Statements

Hazard Classifications

Acute Tox. 3 Oral - Aquatic Chronic 3 - Carc. 1B

Storage Class Code

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 2

Flash Point(F)

176.0 °F

Flash Point(C)

80 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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Khalid M Alkharfy et al.
European journal of drug metabolism and pharmacokinetics, 40(3), 319-323 (2014-06-14)
Thymoquinone (THQ), the active constituent of Nigella sativa seeds, has demonstrated some potential pharmacological activities. The present study was designed to investigate the pharmacokinetic behavior of THQ following intravenous (IV) and oral (PO) administration using an animal model. THQ was
Arindam Chatterjee et al.
Bioorganic & medicinal chemistry, 22(22), 6409-6421 (2014-12-03)
Calpain mediated cleavage of CDK5 natural precursor p35 causes a stable complex formation of CDK5/p25, which leads to hyperphosphorylation of tau. Thus inhibition of this complex is a viable target for numerous acute and chronic neurodegenerative diseases involving tau protein

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