5,6,7,8-Tetrahydroquinoline - CAS 10500-57-9

Catalog:	BB001539
Product Name:	5,6,7,8-Tetrahydroquinoline
CAS:	10500-57-9
Synonyms:	5,6,7,8-tetrahydroquinoline; 5,6,7,8-tetrahydroquinoline

Technical Data

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Computed Properties

IUPAC Name:	5,6,7,8-tetrahydroquinoline
Description:	5,6,7,8-Tetrahydroquinoline can be used to prevent and treat of hyperlipemia.
Molecular Weight:	133.19
Molecular Formula:	C9H11N
Canonical SMILES:	C1CCC2=C(C1)C=CC=N2
InChI:	InChI=1S/C9H11N/c1-2-6-9-8(4-1)5-3-7-10-9/h3,5,7H,1-2,4,6H2
InChI Key:	YQDGQEKUTLYWJU-UHFFFAOYSA-N
Boiling Point:	238 °C
Density:	1.029 g/cm³
Appearance:	Liquid
LogP:	1.96040

Publication Number	Title	Priority Date
CN-112831112-A	Cross-linked polyethylene foam material and preparation method thereof	20210107
CN-112375101-A	Method for preparing chiral nitrogen-phosphorus ligand L-8 containing pyridocyclohexane	20201206
CN-112375040-A	Method for preparing nitrogen-containing heterocyclic compound and derivative thereof by enzyme-chemical cascade method	20201127
WO-2021144478-A2	Combination treatment for fumarate-related diseases	20200506
US-2021336157-A1	Organometallic compound and organic light-emitting device including the same	20200424

PMID	Publication Date	Title	Journal
22438990	20120101	Novel binding mode of a potent and selective tankyrase inhibitor	PloS one
21588661	20100818	5,8-Dimeth-oxy-2-phenyl-1,4-dihydro-quinoline-3-carbonitrile	Acta crystallographica. Section E, Structure reports online
21579499	20100522	8-(4-Chloro-benzyl-idene)-4-(4-chloro-phen-yl)-2-phenyl-5,6,7,8-tetra-hydro-quinoline	Acta crystallographica. Section E, Structure reports online
21580641	20100313	5,6,7,8-Tetra-hydro-quinoline 1-oxide hemihydrate	Acta crystallographica. Section E, Structure reports online
18378452	20080415	Synthesis and characterization of 5,6,7,8-tetrahydroquinoline C5a receptor antagonists	Bioorganic & medicinal chemistry letters

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Related Functional Groups

Quinoline/Isoquinoline

[13676-02-3]
2-Chloro-6-methoxyquinoline
[1535306-28-5]
6-Fluoro-8-iodoquinolin-2(1H)-one
[142425-92-1]
ethyl 4-aminoquinoline-2-carboxylate
[134469-47-9]
Isoquinoline, 1-(chloromethyl)-3,4-dihydro-3,3-dimethyl-, hydrochloride
[1745-07-9]
Isoquinoline,1,2,3,4-tetrahydro-6,7-dimethoxy-
[2241982-85-2]
Isoquinoline-5,8-D2

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GHS Hazard Statement:	H302 (85.71%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	111
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	133.089149355
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	133.089149355
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1