CAFFEINE, 8-BENZYL-

Modify Date: 2025-09-10 03:59:33

CAFFEINE, 8-BENZYL- Structure
CAFFEINE, 8-BENZYL- structure
 Common Name CAFFEINE, 8-BENZYL-
CAS Number 5426-88-0 Molecular Weight 284.31300
Density 1.3g/cm3 Boiling Point 516.1ºC at 760 mmHg
Molecular Formula C15H16N4O2 Melting Point N/A
MSDS N/A Flash Point 265.9ºC

 Names

Name 8-benzyl-1,3,7-trimethylpurine-2,6-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3g/cm3
Boiling Point 516.1ºC at 760 mmHg
Molecular Formula C15H16N4O2
Molecular Weight 284.31300
Flash Point 265.9ºC
Exact Mass 284.12700
PSA 61.82000
LogP 0.56150
Index of Refraction 1.657

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EV6490000
CHEMICAL NAME :
Caffeine, 8-benzyl-
CAS REGISTRY NUMBER :
5426-88-0
BEILSTEIN REFERENCE NO. :
0298246
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C15-H16-N4-O2
MOLECULAR WEIGHT :
284.35
WISWESSER LINE NOTATION :
T56 BN DN FNVNVJ B1 C1R& F1 H1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JAPMA8 Journal of the American Pharmaceutical Association, Scientific Edition. (Washington, DC) V.29-49, 1940-60. For publisher information, see JPMSAE. Volume(issue)/page/year: 43,152,1954
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#04361

 Safety Information

HS Code 2933990090

 Synthetic Route

8-benzyltheophylline structure

8-benzyltheophylline

CAS#:2879-15-4

methyl iodide structure

methyl iodide

CAS#:74-88-4

~%

CAFFEINE, 8-BENZYL- Structure

CAFFEINE, 8-BENZYL-

CAS#:5426-88-0

Literature: Pretorius, Judey; Malan, Sarel F.; Castagnoli Jr., Neal; Bergh, Jacobus J.; Petzer, Jacobus P. Bioorganic and Medicinal Chemistry, 2008 , vol. 16, # 18 p. 8676 - 8684
Caffeine structure

Caffeine

CAS#:58-08-2

Benzene,1,1'-(1,3-butadiene-1,4-diyl)bis- structure

Benzene,1,1'-(1...

CAS#:886-65-7

~15%

CAFFEINE, 8-BENZYL- Structure

CAFFEINE, 8-BENZYL-

CAS#:5426-88-0

3,4,5,7-Tetrahydro-1,3,7-trimethyl-10-syn-phenyl-11-anti-(trans-2-phenylethenyl)-4,5-ethano-1H-purin-2,6-dion structure

3,4,5,7-Tetrahy...

CAS#:79246-59-6

Detail
Literature: Kaupp, Gerd; Grueter, Heinz-Willi Chemische Berichte, 1981 , vol. 114, # 8 p. 2844 - 2858
8-benzyltheophylline structure

8-benzyltheophylline

CAS#:2879-15-4

Dimethyl sulfate structure

Dimethyl sulfate

CAS#:77-78-1

~%

CAFFEINE, 8-BENZYL- Structure

CAFFEINE, 8-BENZYL-

CAS#:5426-88-0

Literature: Kostolansky et al. Chemicke Zvesti, 1956 , vol. 10, p. 96,106 Chem.Abstr., 1956 , p. 13 947 Full Text Show Details Hager et al. Journal of the American Pharmaceutical Association (1912-1977), 1954 , vol. 43, p. 152,154
diphenylethylene structure

diphenylethylene

CAS#:103-30-0

Caffeine structure

Caffeine

CAS#:58-08-2

~4%

1,3,7-trimethyl-8-phenylpurine-2,6-dione structure

1,3,7-trimethyl...

CAS#:6439-88-9

CAFFEINE, 8-BENZYL- Structure

CAFFEINE, 8-BENZYL-

CAS#:5426-88-0

Detail
Literature: Kaupp, Gerd; Grueter, Heinz-Willi Angewandte Chemie, 1980 , vol. 92, # 9 p. 735 - 737
diazomethane structure

diazomethane

CAS#:186581-53-3

~%

CAFFEINE, 8-BENZYL- Structure

CAFFEINE, 8-BENZYL-

CAS#:5426-88-0

Literature: Cook; Thomas Journal of the Chemical Society, 1950 , p. 1884,1886
Benzeneacetamide,N-(6-amino-1,2,3,4-tetrahydro-1,3-dimethyl-2,4-dioxo-5-pyrimidinyl)- structure

Benzeneacetamid...

CAS#:5417-22-1

~%

CAFFEINE, 8-BENZYL- Structure

CAFFEINE, 8-BENZYL-

CAS#:5426-88-0

Literature: Kostolansky et al. Chemicke Zvesti, 1956 , vol. 10, p. 96,106 Chem.Abstr., 1956 , p. 13 947
Caffeine structure

Caffeine

CAS#:58-08-2

Benzene,1,1'-(1,3-butadiene-1,4-diyl)bis- structure

Benzene,1,1'-(1...

CAS#:886-65-7

~15%

CAFFEINE, 8-BENZYL- Structure

CAFFEINE, 8-BENZYL-

CAS#:5426-88-0

3,4,5,7-Tetrahydro-1,3,7-trimethyl-10-syn-phenyl-11-anti-(trans-2-phenylethenyl)-4,5-ethano-1H-purin-2,6-dion structure

3,4,5,7-Tetrahy...

CAS#:79246-59-6

Detail
Literature: Kaupp, Gerd; Grueter, Heinz-Willi Chemische Berichte, 1981 , vol. 114, # 8 p. 2844 - 2858
diphenylethylene structure

diphenylethylene

CAS#:103-30-0

Caffeine structure

Caffeine

CAS#:58-08-2

~4%

1,3,7-trimethyl-8-phenylpurine-2,6-dione structure

1,3,7-trimethyl...

CAS#:6439-88-9

CAFFEINE, 8-BENZYL- Structure

CAFFEINE, 8-BENZYL-

CAS#:5426-88-0

Detail
Literature: Kaupp, Gerd; Grueter, Heinz-Willi Angewandte Chemie, 1980 , vol. 92, # 9 p. 735 - 737
diphenylethylene structure

diphenylethylene

CAS#:103-30-0

Caffeine structure

Caffeine

CAS#:58-08-2

~%

1,3,7-trimethyl-8-phenylpurine-2,6-dione structure

1,3,7-trimethyl...

CAS#:6439-88-9

CAFFEINE, 8-BENZYL- Structure

CAFFEINE, 8-BENZYL-

CAS#:5426-88-0

Detail
Literature: Kaupp, Gerd; Grueter, Heinz-Willi Chemische Berichte, 1981 , vol. 114, # 8 p. 2844 - 2858

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

8-Benzyl-3,7-dihydro-1,3,7-trimethyl-1H-purin-2,6-dion
8-Benzyl-1,3,7-trimethyl-3,7-dihydro-purin-2,6-dion
8-benzyl-1,3,7-trimethyl-3,7-dihydro-purine-2,6-dione
8-Benzyl-caffeine
CAFFEINE,8-BENZYL
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.
Top Suppliers:I want be here

Get all suppliers and price by the below link:

CAFFEINE, 8-BENZYL- suppliers

CAFFEINE, 8-BENZYL- price

Related Compounds: More...
Caffeine, 8- (ethylthio)-
6287-57-6
Caffeine,8,8'-heptamethylenedi- (8CI)
5426-95-9
Caffeine,8,8'-(ethylenedinitrosimino)di- (7CI,8CI)
6335-98-4
(S)-8-Benzyl-4-oxo-2,3,10,10a-tetrahydro-1H,4H-9-oxa-3a-aza-8-azonia-benzo[f]azulene; bromide
100044-98-2
N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-2-ethoxy-3,5-dimethoxybenzamide,hydrochloride
83130-77-2
N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-5-ethylsulfanyl-2,3-dimethoxybenzamide,oxalic acid
83131-01-5
(1S)-8-benzyl-3-methyl-3,8-diazabicyclo[3.2.1]octane
57727-91-0
N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-2-ethoxy-3-methoxybenzamide,hydrochloride
83130-75-0
2-(8-Benzyl-2,4-dioxo-1,3,8-triazaspiro[4.5]decan-3-yl)acetic acid hydrochloride
28936-99-4
1-Methyl-2-[(2,4,6-trifluorophenyl)methylidene]hydrazine
1264837-70-8
2-(3-Fluoro-4-methoxyphenyl)butanedioic acid
1268133-33-0
2-(5-Fluoro-2-methoxyphenyl)butanedioic acid
1267404-80-7
6-Chloroisoquinolin-2-ium-2-olate
410086-26-9
3-(2-Chloro-6-fluorophenyl)-2,2-dimethylcyclopropane-1-carboxylic acid
1267003-36-0
2H-Benzimidazole-2-thione, 5-bromo-6-fluoro-1,3-dihydro-1-[(tetrahydro-2-thienyl)methyl]-
1542874-15-6
6-Methoxy-1,2,3,4-tetrahydroisoquinolin-4-amine
1781903-16-9
5-(4-(3-Phenylpropyl)phenyl)quinoline-8-carbaldehyde
1403380-11-9
5-(4-Octylphenyl)-8-quinolinecarboxaldehyde
1403380-16-4
5-[4-(2-Cyclohexylethyl)phenyl]-8-quinolinecarboxaldehyde
1403380-18-6
Chemsrc provides CAFFEINE, 8-BENZYL-(CAS#:5426-88-0) MSDS, density, melting point, boiling point, structure, formula, molecular weight etc. Articles of CAFFEINE, 8-BENZYL- are included as well.>> amp version: CAFFEINE, 8-BENZYL-

Home | MSDS/SDS Database Search | Journals | Product Classification | Biologically Active Compounds | Selling Leads | About Us | Disclaimer

Copyright © 2024 ChemSrc All Rights Reserved