Benz[a]anthracene-7-acetonitrile

Modify Date: 2024-01-11 13:26:20

Benz[a]anthracene-7-acetonitrile Structure
Benz[a]anthracene-7-acetonitrile structure
Common Name Benz[a]anthracene-7-acetonitrile
CAS Number 63018-69-9 Molecular Weight 267.32400
Density 1.226g/cm3 Boiling Point 525.7ºC at 760 mmHg
Molecular Formula C20H13N Melting Point N/A
MSDS N/A Flash Point 309.4ºC

 Names

Name Benz[a]anthracene-7-acetonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.226g/cm3
Boiling Point 525.7ºC at 760 mmHg
Molecular Formula C20H13N
Molecular Weight 267.32400
Flash Point 309.4ºC
Exact Mass 267.10500
PSA 23.79000
LogP 5.21228
Index of Refraction 1.754

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CV8975000
CHEMICAL NAME :
Benz(a)anthracen-7-acetonitrile
CAS REGISTRY NUMBER :
63018-69-9
BEILSTEIN REFERENCE NO. :
3335132
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C20-H13-N
MOLECULAR WEIGHT :
267.34
WISWESSER LINE NOTATION :
L D6 B666J J1CN

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
600 mg/kg
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Tumorigenic - tumors at site of application

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Bacteria - Escherichia coli
DOSE/DURATION :
30 umol/L
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 203,81,1988

 Synthetic Route

~85%

Benz[a]anthracene-7-acetonitrile Structure

Benz[a]anthrace...

CAS#:63018-69-9

Literature: Sangaiah, R.; Gold, A.; Toney, G. E. Journal of Organic Chemistry, 1983 , vol. 48, # 10 p. 1632 - 1638

~%

Benz[a]anthracene-7-acetonitrile Structure

Benz[a]anthrace...

CAS#:63018-69-9

Literature: Badger; Cook Journal of the Chemical Society, 1940 , p. 409,411

 Synonyms

2-benzo[a]anthracen-7-ylacetonitrile
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