Anthracene Brown, water soluble

Modify Date: 2026-06-30 17:25:38

Anthracene Brown, water soluble Structure
Anthracene Brown, water soluble structure
Common Name Anthracene Brown, water soluble
CAS Number 602-64-2 Molecular Weight 256.21
Density 1.659g/cm3 Boiling Point 452.7ºC at 760 mmHg
Molecular Formula C14H8O5 Melting Point N/A
MSDS N/A Flash Point 241.7ºC

 Use of Anthracene Brown, water soluble


Anthragallol can insert base pairs of DNA. Anthragallol exhibits cytotoxicity by binding to DNA[1].

 Names

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name anthragallol
Synonym More Synonyms

 Anthracene Brown, water soluble Biological Activity

This table contains bioactivity, target information and biological‑assay experimental data of this compound.

Description Anthragallol can insert base pairs of DNA. Anthragallol exhibits cytotoxicity by binding to DNA[1].
Related Catalog
References

[1]. Gao Y, et, al. Spectroscopic studies on the interaction between anthragallol and DNA using of ethidium bromide as a fluorescence probe. Spectrochim Acta A Mol Biomol Spectrosc. 2015 Apr 15;141:239-43.  

 Chemical & Physical Properties

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density 1.659g/cm3
Boiling Point 452.7ºC at 760 mmHg
Molecular Formula C14H8O5
Molecular Weight 256.21
Flash Point 241.7ºC
Exact Mass 256.03700
PSA 94.83000
LogP 1.57880
Index of Refraction 1.772
InChIKey AHKDJQYHVWSRLT-UHFFFAOYSA-N
SMILES O=C1c2ccccc2C(=O)c2c1cc(O)c(O)c2O

 Toxicological Information

This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CB8198000
CHEMICAL NAME :
Anthraquinone, 1,2,3-trihydroxy-
CAS REGISTRY NUMBER :
602-64-2
BEILSTEIN REFERENCE NO. :
2058042
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H8-O5
MOLECULAR WEIGHT :
256.22
WISWESSER LINE NOTATION :
L C666 BV IVJ DQ EQ FQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
20 ug/plate
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 40,203,1976

 Synthetic Route

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

~75%

Anthracene Brown, water soluble Structure

Anthracene Brow...

CAS#:602-64-2

Learn More
Literature: Dhananjeyan, Mugunthu R.; Milev, Youli P.; Kron, Michael A.; Nair, Muraleedharan G. Journal of Medicinal Chemistry, 2005 , vol. 48, # 8 p. 2822 - 2830

~%

Anthracene Brown, water soluble Structure

Anthracene Brow...

CAS#:602-64-2

Learn More
Literature: Chemische Berichte, , vol. 10, p. 42

~%

Anthracene Brown, water soluble Structure

Anthracene Brow...

CAS#:602-64-2

Learn More
Literature: Synthesis, , # 5 p. 381 - 383

~%

Anthracene Brown, water soluble Structure

Anthracene Brow...

CAS#:602-64-2

Learn More
Literature: Journal of the Chemical Society, , vol. 63, p. 1167,1172 Journal of the Chemical Society, , vol. 67, p. 823

~%

Anthracene Brown, water soluble Structure

Anthracene Brow...

CAS#:602-64-2

Learn More
Literature: Monatshefte fuer Chemie, , vol. 23, p. 1017,1018

~%

Anthracene Brown, water soluble Structure

Anthracene Brow...

CAS#:602-64-2

Learn More
Literature: DE158278 ;

~%

Anthracene Brown, water soluble Structure

Anthracene Brow...

CAS#:602-64-2

Learn More
Literature: Journal of the Chemical Society, , vol. 63, p. 1167,1172 Journal of the Chemical Society, , vol. 67, p. 823

~%

Anthracene Brown, water soluble Structure

Anthracene Brow...

CAS#:602-64-2

Learn More
Literature: Chemische Berichte, , vol. 10, p. 42

 Anthracene Brown, water solubleBioassay

View more

This table contains target information, in‑vitro & in‑vivo assay data for this compound.

Name: Binding affinity to Mcl-1 after 30 mins by florescence polarization assay
Source: ChEMBL
Target: Induced myeloid leukemia cell differentiation protein Mcl-1
External Id: CHEMBL2188686
Name: Binding affinity to Bcl-2 after 30 mins by florescence polarization assay
Source: ChEMBL
Target: Apoptosis regulator Bcl-2
External Id: CHEMBL2188685
Name: Compound causing 100% mortality of Brugia malayi female adult worms at 25 ppm concent...
Source: ChEMBL
Target: Brugia malayi
External Id: CHEMBL877085
Name: Compound causing 100% mortality of Brugia malayi female adult worms at 3.125 ppm conc...
Source: ChEMBL
Target: Brugia malayi
External Id: CHEMBL827347
Name: Compound causing 100% mortality of Brugia malayi female adult worms at 6.25 ppm conce...
Source: ChEMBL
Target: Brugia malayi
External Id: CHEMBL827346
Name: Compound causing 100% mortality of Brugia malayi female adult worms at 12.5 ppm conce...
Source: ChEMBL
Target: Brugia malayi
External Id: CHEMBL877087
Name: Compound causing 100% mortality of Brugia malayi female adult worms at 50 ppm concent...
Source: ChEMBL
Target: Brugia malayi
External Id: CHEMBL877086
Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
Name: Antifilarial activity against Brugia malayi (male) at 5 ppm in the first 5 days (NT=N...
Source: ChEMBL
Target: Brugia malayi
External Id: CHEMBL827351
Name: Displacement of FAM-Bid BH3 peptide from recombinant Mcl-1 (unknown origin) expressed...
Source: ChEMBL
Target: Induced myeloid leukemia cell differentiation protein Mcl-1
External Id: CHEMBL2437894
Total 14, Current Page 1 of 2
1
2

 Synonyms

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

1,2,3-trihydroxyanthracene-9,10-dione
MFCD00019146
Anthracene Brown, Water Soluble
EINECS 210-022-4

 Anthracene Brown, water soluble | FAQ

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the molecular formula of anthragallol?
A: Molecular formula of anthragallol is C14H8O5.
Q: What is the SMILES notation of anthragallol?
A: SMILES notation of anthragallol is O=C1c2ccccc2C(=O)c2c1cc(O)c(O)c2O.
Q: What English synonyms does anthragallol have?
A: English synonyms of anthragallol: 1,2,3-trihydroxyanthracene-9,10-dione, MFCD00019146, Anthracene Brown, Water Soluble, EINECS 210-022-4.
Q: What is the LogP of anthragallol?
A: LogP of anthragallol is 1.57880.
Q: What is the molecular weight of anthragallol?
A: Molecular weight of anthragallol is 256.21.
Q: What is the CAS number of anthragallol?
A: CAS number of anthragallol is 602-64-2.
Q: What is the InChIKey of anthragallol?
A: InChIKey of anthragallol is AHKDJQYHVWSRLT-UHFFFAOYSA-N.
Q: What is the English name of anthragallol?
A: The English name of anthragallol is anthragallol.
Q: What are the uses of anthragallol?
A: Main uses of anthragallol: Anthragallol can insert base pairs of DNA. Anthragallol exhibits cytotoxicity by binding to DNA[1].
Q: What is the polar surface area (PSA) of anthragallol?
A: Polar surface area (PSA) of anthragallol is 94.83000.

 Anthracene Brown, water solublefactory

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Shanghai Nianxing Industrial Co., Ltd
Dayang Chem (Hangzhou) Co., Ltd.
The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.