9,10-Anthracenedione,1-amino-4-chloro

Modify Date: 2025-08-27 12:01:37

9,10-Anthracenedione,1-amino-4-chloro Structure
9,10-Anthracenedione,1-amino-4-chloro structure
Common Name 9,10-Anthracenedione,1-amino-4-chloro
CAS Number 2872-47-1 Molecular Weight 257.67200
Density 1.486g/cm3 Boiling Point 500.9ºC at 760mmHg
Molecular Formula C14H8ClNO2 Melting Point N/A
MSDS N/A Flash Point 256.7ºC

 Names

Name 1-amino-4-chloroanthracene-9,10-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.486g/cm3
Boiling Point 500.9ºC at 760mmHg
Molecular Formula C14H8ClNO2
Molecular Weight 257.67200
Flash Point 256.7ºC
Exact Mass 257.02400
PSA 60.16000
LogP 3.27880
Vapour Pressure 3.64E-10mmHg at 25°C
Index of Refraction 1.711
InChIKey AWACQBFBMROGQC-UHFFFAOYSA-N
SMILES Nc1ccc(Cl)c2c1C(=O)c1ccccc1C2=O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CB5430000
CHEMICAL NAME :
Anthraquinone, 1-amino-4-chloro-
CAS REGISTRY NUMBER :
2872-47-1
BEILSTEIN REFERENCE NO. :
0916373
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C14-H8-Cl-N-O2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1630 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 49(4),90,1984
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1320 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 49(4),90,1984

 Safety Information

HS Code 2922399090

 Synthetic Route

 Customs

HS Code 2922399090
Summary 2922399090 other amino-aldehydes, amino-ketones and amino-quinones, other than those containing more than one kind of oxygen function; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 9,10-Anthracenedione,1-amino-4-chloroBioassay

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Name: Small-molecule inhibitors of ST2 (IL1RL1)
Source: 20881
Target: interleukin-1 receptor-like 1 isoform [homo sapiens]
External Id: ST2_IL33_Inhibitors_Primary_Screening_77700
Name: Antagonist activity at human adenosine 2A receptor expressed in HEK293 cells assessed...
Source: ChEMBL
Target: Adenosine receptor A2a
External Id: CHEMBL1071497
Name: Inhibition of human adenosine 2A receptor at 1 mM
Source: ChEMBL
Target: Adenosine receptor A2a
External Id: CHEMBL1071496
Name: Alphascreen assay for small molecules abrogating mHTT-CaM Interaction
Source: 24983
Target: Huntingtin
External Id: KUHTS-Muma KU-CaM-Htt INH-01
Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
Name: Inhibition of human adenosine 2A receptor
Source: ChEMBL
Target: Adenosine receptor A2a
External Id: CHEMBL1071493
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1

 Synonyms

1-Amino-4-chloro-9,10-anthracenedione
1-Amino-4-chlor-anthrachinon
4-Amino-4-chloroanthraquinone
ANTHRAQUINONE,1-AMINO-4-CHLORO
1-amino-4-chloro-anthraquinone
4-Chloro-1-aminoanthraquinone
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