6-ACETOXY-BENZO(a)PYRENE

Modify Date: 2025-09-29 22:18:10

6-ACETOXY-BENZO(a)PYRENE Structure
6-ACETOXY-BENZO(a)PYRENE structure
Common Name 6-ACETOXY-BENZO(a)PYRENE
CAS Number 53555-67-2 Molecular Weight 310.34500
Density 1.327g/cm3 Boiling Point 528.9ºC at 760 mmHg
Molecular Formula C22H14O2 Melting Point N/A
MSDS N/A Flash Point 159.7ºC

 Names

Name benzo[b]pyren-6-yl acetate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.327g/cm3
Boiling Point 528.9ºC at 760 mmHg
Molecular Formula C22H14O2
Molecular Weight 310.34500
Flash Point 159.7ºC
Exact Mass 310.09900
PSA 26.30000
LogP 5.66250
Index of Refraction 1.819
InChIKey PSUANBYSDSSXCT-UHFFFAOYSA-N
SMILES CC(=O)Oc1c2ccccc2c2ccc3cccc4ccc1c2c43

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DJ8297000
CHEMICAL NAME :
Benzo(a)pyren-6-ol, acetate
CAS REGISTRY NUMBER :
53555-67-2
BEILSTEIN REFERENCE NO. :
2058877
LAST UPDATED :
199612
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C22-H14-O2
MOLECULAR WEIGHT :
310.36
WISWESSER LINE NOTATION :
L D6 B6666 2AB TJ JOV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Unscheduled DNA synthesis
TEST SYSTEM :
Rodent - hamster Embryo
DOSE/DURATION :
10 ug/L/18H
REFERENCE :
CBINA8 Chemico-Biological Interactions. (Elsevier Scientific Pub. Ireland Ltd., POB 85, Limerick, Ireland) V.1- 1969- Volume(issue)/page/year: 13,105,1976

 Synthetic Route

 Synonyms

Benzo[a]pyren-6-ol,acetate
acetic acid benzo[def]chrysen-6-yl ester
Benzo(a)pyrene-6-yl acetate
benzo<a>pyren-6-yl acetate
Benzo[def]chrysenyl-(6)-acetat
6-benzo[a]pyrenyl acetate
Essigsaeure-benzo[def]chrysen-6-ylester
6-Acetoxybenzo(a)pyrene
6-acetoxybenzopiren
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