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4921-49-7

4921-49-7 structure
4921-49-7 structure

Name 8-chloro-1,3,7-trimethylpurine-2,6-dione
Synonyms EINECS 225-552-1
8-chloro-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,8-dione
8-Chloro-1,3,7-trimethyl-3,7-dihydr
8-chloro-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione (8-chlorocaffeine)
Dimenhydrinate Impurity E (8-Chlorocaffeine)
1,3,7-Trimethyl-2,6-dioxo-8-chloro.1H,3H,7H-xanthine
Dimenhydrinate Related Compound E (8-chloro-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione)
Caffeine Impurity A
1,3,7-Trimethyl-8-chloroxanthine
8-chloro-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione
Dimenhydrinate Related Compound E
8-Chlor-3,7-dihydro-1,3,7-trimethyl-1H-purin-2,6-dion
CAFFEINE,8-CHLORO
Dimenhydrinate Impurity E
8-Chlorocaffein
Dimenhydrinate Related Compound E (15 mg) (8-chloro-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione)
8-chloro-1,3,7-trimethylxanthine
Dimenhydrinate Impurity 5 (Dimenhydrinate Impurity E)
8-chloro-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Dimenhydrinate Impurity 3
Caffeine Impurity 2
8-Chloro Caffeine
8-Chloro-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione
1H-Purine-2,6-dione, 8-chloro-3,7-dihydro-1,3,7-trimethyl
Density 1.6g/cm3
Boiling Point 425.4ºC at 760mmHg
Melting Point 190-192ºC
Molecular Formula C8H9ClN4O2
Molecular Weight 228.63600
Flash Point 211.1ºC
Exact Mass 228.04100
PSA 61.82000
Index of Refraction 1.696

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EV6494000
CHEMICAL NAME :
Caffeine, 8-chloro-
CAS REGISTRY NUMBER :
4921-49-7
BEILSTEIN REFERENCE NO. :
0232628
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C8-H9-Cl-N4-O2
MOLECULAR WEIGHT :
228.66
WISWESSER LINE NOTATION :
T56 BN DN FNVNVJ B1 CG F1 H1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Cytogenetic analysis
TEST SYSTEM :
Rodent - hamster Lung
DOSE/DURATION :
4 mmol/L
REFERENCE :
HEREAY Hereditas (Lund, Sweden). (Gjoerloffsgatan 121, S-261 34 Landskrona, Sweden) V.1- 1947- Volume(issue)/page/year: 75,277,1973
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