5-benzylquinolin-8-ol

Modify Date: 2025-12-28 16:58:51

5-benzylquinolin-8-ol Structure
5-benzylquinolin-8-ol structure
Common Name 5-benzylquinolin-8-ol
CAS Number 6954-93-4 Molecular Weight 235.28100
Density 1.209g/cm3 Boiling Point 432.1ºC at 760 mmHg
Molecular Formula C16H13NO Melting Point N/A
MSDS N/A Flash Point 215.1ºC

 Names

Name 5-benzylquinolin-8-ol
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.209g/cm3
Boiling Point 432.1ºC at 760 mmHg
Molecular Formula C16H13NO
Molecular Weight 235.28100
Flash Point 215.1ºC
Exact Mass 235.10000
PSA 33.12000
LogP 3.53120
Index of Refraction 1.678
InChIKey XMMNJZRNOIZBDA-UHFFFAOYSA-N
SMILES Oc1ccc(Cc2ccccc2)c2cccnc12

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VC4550000
CHEMICAL NAME :
8-Quinolinol, 5-benzyl-
CAS REGISTRY NUMBER :
6954-93-4
BEILSTEIN REFERENCE NO. :
0180103
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H13-N-O
MOLECULAR WEIGHT :
235.30
WISWESSER LINE NOTATION :
T66 BNJ G1R& JQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1024 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 2,57,1950

 Safety Information

HS Code 2933499090

 Synthetic Route

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5-benzylquinolin-8-ol Structure

5-benzylquinoli...

CAS#:6954-93-4

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Literature: McMaster; Brunner Journal of the American Chemical Society, 1935 , vol. 57, p. 1697

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5-benzylquinolin-8-ol Structure

5-benzylquinoli...

CAS#:6954-93-4

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Literature: McMaster; Brunner Journal of the American Chemical Society, 1935 , vol. 57, p. 1697

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5-benzylquinolin-8-ol Structure

5-benzylquinoli...

CAS#:6954-93-4

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Literature: Arventi Annales Scientifiques de l'Universite de Jassy, Section 1: Mathematiques, Physique, Chimie, 1937 , vol. 23, p. 344,353 Chem. Zentralbl., 1937 , vol. 108, # II p. 1575

~%

5-benzylquinolin-8-ol Structure

5-benzylquinoli...

CAS#:6954-93-4

Learn More
Literature: Arventi Annales Scientifiques de l'Universite de Jassy, Section 1: Mathematiques, Physique, Chimie, 1937 , vol. 23, p. 344,353 Chem. Zentralbl., 1937 , vol. 108, # II p. 1575

 Customs

HS Code 2933499090
Summary 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 5-benzylquinolin-8-olBioassay

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Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
Name: uHTS identification of small molecule modulators of NR3A
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1015-NR3A-Primary-Assay
Name: uHTS identification of small molecule modulators of Rev-erb Alpha.
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1016-RevErbaLBD-Primary-Assay
Name: qHTS for Inhibitors of Polymerase Iota
Source: NCGC
Target: DNA polymerase iota [Homo sapiens]
External Id: PolI100
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 Synonyms

5-Benzyl-8-quinolinol
5-Benzyl-8-hydroxy-chinolin
5-Benzyl-chinolin-8-ol
8-Quinolinol,5-benzyl
5-benzyl-quinolin-8-ol
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