Theophylline, 8-cinnamyl

Modify Date: 2024-02-21 13:42:03

Theophylline, 8-cinnamyl Structure
Theophylline, 8-cinnamyl structure
Common Name Theophylline, 8-cinnamyl
CAS Number 74039-67-1 Molecular Weight 296.32400
Density 1.319g/cm3 Boiling Point 579.3ºC at 760 mmHg
Molecular Formula C16H16N4O2 Melting Point N/A
MSDS N/A Flash Point 304.2ºC

 Names

Name Theophylline, 8-cinnamyl

 Chemical & Physical Properties

Density 1.319g/cm3
Boiling Point 579.3ºC at 760 mmHg
Molecular Formula C16H16N4O2
Molecular Weight 296.32400
Flash Point 304.2ºC
Exact Mass 296.12700
PSA 72.68000
LogP 1.21620
Index of Refraction 1.666

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XH5093200
CHEMICAL NAME :
Theophylline, 8-cinnamyl-
CAS REGISTRY NUMBER :
74039-67-1
BEILSTEIN REFERENCE NO. :
0035201
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H16-N4-O2
MOLECULAR WEIGHT :
296.36
WISWESSER LINE NOTATION :
T56 BM DN FNVNVJ C2U1R& F1 H1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#04469

 Synthetic Route

~%

Theophylline, 8-cinnamyl Structure

Theophylline, 8...

CAS#:74039-67-1

Literature: Hager et al. Journal of the American Pharmaceutical Association (1912-1977), 1954 , vol. 43, p. 152,154

 Precursor & DownStream

Precursor  1

DownStream  0