7,12-DIMETHYLBENZ(A)ANTHRACENE-3,4-DIOL

Modify Date: 2026-06-29 23:33:32

7,12-DIMETHYLBENZ(A)ANTHRACENE-3,4-DIOL Structure
7,12-DIMETHYLBENZ(A)ANTHRACENE-3,4-DIOL structure
Common Name 7,12-DIMETHYLBENZ(A)ANTHRACENE-3,4-DIOL
CAS Number 71964-72-2 Molecular Weight 288.34000
Density 1.303g/cm3 Boiling Point 561ºC at 760 mmHg
Molecular Formula C20H16O2 Melting Point N/A
MSDS N/A Flash Point 269.9ºC

 Names

Name 7,12-dimethylbenzo[a]anthracene-3,4-diol

 Chemical & Physical Properties

Density 1.303g/cm3
Boiling Point 561ºC at 760 mmHg
Molecular Formula C20H16O2
Molecular Weight 288.34000
Flash Point 269.9ºC
Exact Mass 288.11500
PSA 40.46000
LogP 5.17420
Index of Refraction 1.784
InChIKey UOGIXWFTUIUULQ-UHFFFAOYSA-N
SMILES Cc1c2ccccc2c(C)c2c1ccc1c(O)c(O)ccc12

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CW4635000
CHEMICAL NAME :
Benz(a)anthracene-3,4-diol, 7,12-dimethyl-
CAS REGISTRY NUMBER :
71964-72-2
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C20-H16-O2
MOLECULAR WEIGHT :
288.36
WISWESSER LINE NOTATION :
L D6 B666J C1 J1 OQ PQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
35 ug/kg
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Skin and Appendages - tumors

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
10 nmol/plate
REFERENCE :
46OJAN "Chemical Analysis and Biological Fate: Polynuclear Aromatic Hydrocarbons, 5th International Symposium, 1980," Cooke, M., and A.J. Dennis, eds., Columbus, OH, Battelle Press, 1981 Volume(issue)/page/year: -,675,1981

 Synthetic Route

~0%

7,12-DIMETHYLBENZ(A)ANTHRACENE-3,4-DIOL Structure

7,12-DIMETHYLBE...

CAS#:71964-72-2

Learn More
Literature: Sukumaran, K.B.; Harvey, Ronald G. Journal of Organic Chemistry, 1980 , vol. 45, # 22 p. 4407 - 4413

~%

7,12-DIMETHYLBENZ(A)ANTHRACENE-3,4-DIOL Structure

7,12-DIMETHYLBE...

CAS#:71964-72-2

Learn More
Literature: Harvey, Ronald G.; Dai, Qing; Ran, Chongzhao; Penning, Trevor M. Journal of Organic Chemistry, 2004 , vol. 69, # 6 p. 2024 - 2032

~%

7,12-DIMETHYLBENZ(A)ANTHRACENE-3,4-DIOL Structure

7,12-DIMETHYLBE...

CAS#:71964-72-2

Learn More
Literature: Harvey, Ronald G.; Dai, Qing; Ran, Chongzhao; Penning, Trevor M. Journal of Organic Chemistry, 2004 , vol. 69, # 6 p. 2024 - 2032

~%

7,12-DIMETHYLBENZ(A)ANTHRACENE-3,4-DIOL Structure

7,12-DIMETHYLBE...

CAS#:71964-72-2

Learn More
Literature: Harvey, Ronald G.; Dai, Qing; Ran, Chongzhao; Penning, Trevor M. Journal of Organic Chemistry, 2004 , vol. 69, # 6 p. 2024 - 2032

~%

7,12-DIMETHYLBENZ(A)ANTHRACENE-3,4-DIOL Structure

7,12-DIMETHYLBE...

CAS#:71964-72-2

Learn More
Literature: Sukumaran, K.B.; Harvey, Ronald G. Journal of Organic Chemistry, 1980 , vol. 45, # 22 p. 4407 - 4413

~%

7,12-DIMETHYLBENZ(A)ANTHRACENE-3,4-DIOL Structure

7,12-DIMETHYLBE...

CAS#:71964-72-2

Learn More
Literature: Sukumaran, K.B.; Harvey, Ronald G. Journal of Organic Chemistry, 1980 , vol. 45, # 22 p. 4407 - 4413

 7,12-DIMETHYLBENZ(A)ANTHRACENE-3,4-DIOLBioassay

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Name: Tumor initiating activity measured as incidence of % aberrent cells with chromosomal ...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL776218
Name: Tumor initiating activity measured as incidence of % aberrent cells with chromosomal ...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL776818
Name: Tumor initiating activity measured as number of chromosomal aberrations per cell, at ...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL776820
Name: Tumor initiating activity measured as number of chromosomal aberrations per cell, at ...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL776819
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