azaphenanthrene

Modify Date: 2025-08-24 21:07:10

azaphenanthrene Structure
azaphenanthrene structure
 Common Name azaphenanthrene
CAS Number 85-02-9 Molecular Weight 179.217
Density 1.2±0.1 g/cm3 Boiling Point 350.4±11.0 °C at 760 mmHg
Molecular Formula C13H9N Melting Point 89-91 °C
MSDS N/A Flash Point 155.9±11.9 °C

 Names

Name Benzo[f]quinoline
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 350.4±11.0 °C at 760 mmHg
Melting Point 89-91 °C
Molecular Formula C13H9N
Molecular Weight 179.217
Flash Point 155.9±11.9 °C
Exact Mass 179.073502
PSA 12.89000
LogP 3.32
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.727
InChIKey HCAUQPZEWLULFJ-UHFFFAOYSA-N
SMILES c1ccc2c(c1)ccc1ncccc12

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DK1428000
CHEMICAL NAME :
Benzo(f)quinoline
CAS REGISTRY NUMBER :
85-02-9
BEILSTEIN REFERENCE NO. :
0120261
LAST UPDATED :
199806
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C13-H9-N
MOLECULAR WEIGHT :
179.23
WISWESSER LINE NOTATION :
T B666 FNJ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Phage inhibition capacity
TEST SYSTEM :
Bacteria - Escherichia coli
DOSE/DURATION :
7500 ng/well
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 260,349,1991

 Safety Information

Hazard Codes Xn: Harmful;
Risk Phrases R40
Safety Phrases S45-S36/37/39-S26
RTECS DK1428000
HS Code 2933990090

 Synthetic Route

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 azaphenanthreneBioassay

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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT 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: Cytochrome P450 Family 1 Subfamily A Member 2 (CYP1A2) small molecule antagonists: lu...
Source: 824
External Id: CYP273
Name: Counterscreen for inhibitors of the Steroid Receptor Coactivator 1 (SRC1; NCOA1): Lum...
Source: The Scripps Research Institute Molecular Screening Center
Target: transactivating tegument protein VP16 [Human herpesvirus 1]
External Id: VP16_INH_LUMI_1536_3X%INH CSRUN for SRC1
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: Luminescence-based cell-based high throughput confirmation assay for inhibitors of th...
Source: The Scripps Research Institute Molecular Screening Center
Target: nuclear receptor coactivator 1 isoform 1 [Homo sapiens]
External Id: SRC1_INH_LUMI_1536_3X%INH CRUN
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: p53 small molecule agonists, cell-based qHTS assay: qHTS cell viability counter scree...
Source: 824
Target: N/A
External Id: P53600
Name: p53 small molecule agonists, cell-based qHTS assay with rat liver microsomes: qHTS ce...
Source: 824
Target: N/A
External Id: P53MS958
Name: p53 small molecule agonists, cell-based qHTS assay with rat liver microsomes: Summary
Source: 824
External Id: P53MS482
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 Synonyms

Naphthopyridine
azaphenanthrene
b-Naphthoquinoline
β-Naphthoquinoline
EINECS 201-582-0
Benzo[f]quinoline
MFCD00022235
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