7-[2-(benzylamino)ethyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride

Modify Date: 2024-01-12 15:04:17

7-[2-(benzylamino)ethyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride Structure
7-[2-(benzylamino)ethyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride structure
Common Name 7-[2-(benzylamino)ethyl]-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride
CAS Number 1236-36-8 Molecular Weight 349.81500
Density N/A Boiling Point 546.5ºC at 760mmHg
Molecular Formula C16H20ClN5O2 Melting Point N/A
MSDS N/A Flash Point 284.3ºC

 Names

Name 7-[2-(benzylamino)ethyl]-1,3-dimethylpurine-2,6-dione,hydrochloride
Synonym More Synonyms

 Chemical & Physical Properties

Boiling Point 546.5ºC at 760mmHg
Molecular Formula C16H20ClN5O2
Molecular Weight 349.81500
Flash Point 284.3ºC
Exact Mass 349.13100
PSA 73.85000
LogP 1.41640
Vapour Pressure 5.35E-12mmHg at 25°C

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XH4800000
CHEMICAL NAME :
Theophylline, 7-(2-(benzylamino)ethyl)-, hydrochloride
CAS REGISTRY NUMBER :
1236-36-8
LAST UPDATED :
197906
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H19-N5-O2
MOLECULAR WEIGHT :
313.40
WISWESSER LINE NOTATION :
T56 BN DN FNVNVJ B2M1R& F1 H1 &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
69 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 8,190,1958

 Safety Information

HS Code 2933990090

 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

7-(2-(Benzylamino)ethyl)theophylline hydrochloride
EINECS 214-977-8
Theophylline,7-(2-(benzylamino)ethyl)-,hydrochloride
7-(2-Benzylamino-aethyl)-1,3-dimethyl-3,7-dihydro-purin-2,6-dion,Hydrochlorid
7-[2-(benzylamino)ethyl]-1,3-dimethylpurine-2,6-dione hydrochloride
7-(2-(Benzylamino)ethyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione monohydrochloride
7-(2-benzylamino-ethyl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione,hydrochloride