1-Propanamine,3-dibenzo[b,e]thiepin-11(6H)-ylidene-N,N-dimethyl-
- 中文别名：度琉平
- 中文释义：度琉平
- 英文别名：dothiepin;
Dothep;
Dolsulepine;
dosulepin;
11(16H)-(3-[dimethylamino]propylidene)dibenz[b,e]thiopine;
Dosulepine;
DOTHIEPIN;
Prothiaden;
iz914;
11-(3-dimethylaminopropylidene)-6,11-dihydrodibenzo(b,e)thiepin;
Prothiadene;
Methiaden;
11-(3-Dimethylamino-propyliden)-6,11-dihydro-dibenzothiepin
- CAS No.：113-53-1
- 分子式：
C19H21NS
- 分子量：295.44
- 精确分子量：295.13900
- PSA：28.54000
- InChI：The Key: PHTUQLWOUWZIMZ-UHFFFAOYSA-N
- 分子结构式：
物化性质
- 外观与性状：
- 淡黄色低熔点固体
- 密度：
- 1.148 g/cm3
- 熔点：
- 55-57ºC
- 沸点：
- 430.9ºC at 760 mmHg
- 闪点：
- 214.4ºC
安全信息
- 外观与性状：
- 淡黄色低熔点固体
- 密度：
- 1.148 g/cm3
- 熔点：
- 55-57ºC
- 沸点：
- 430.9ºC at 760 mmHg
- 闪点：
- 214.4ºC
毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UI1555000
- CHEMICAL NAME :
- Propylamine, N,N-dimethyl-3-(dibenzo(b,e)thiepin-delta-sup(11(6H), gamma))-
- CAS REGISTRY NUMBER :
- 113-53-1
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 9
- MOLECULAR FORMULA :
- C19-H21-N-S
- MOLECULAR WEIGHT :
- 295.47
- WISWESSER LINE NOTATION :
- T C676 BY IS JHJ BU3N1&1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Human - infant
- DOSE/DURATION :
- 100 mg/kg
- TOXIC EFFECTS :
- Behavioral - convulsions or effect on seizure threshold Behavioral - coma Cardiac - arrhythmias (including changes in conduction)
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Human - woman
- DOSE/DURATION :
- 4500 ug/kg
- TOXIC EFFECTS :
- Behavioral - changes in motor activity (specific assay)
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Human
- DOSE/DURATION :
- 3214 ug/kg/12D-I
- TOXIC EFFECTS :
- Behavioral - changes in psychophysiological tests
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Human
- DOSE/DURATION :
- 2143 ug/kg/8D-I
- TOXIC EFFECTS :
- Behavioral - sleep Behavioral - hallucinations, distorted perceptions Behavioral - changes in psychophysiological tests
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 31 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- DOSE :
- 150 mg/kg
- SEX/DURATION :
- male 6 day(s) pre-mating
- TOXIC EFFECTS :
- Reproductive - Fertility - pre-implantation mortality (e.g. reduction in number of implants per female; total number of implants per corpora lutea)
- TYPE OF TEST :
- Cytogenetic analysis
MUTATION DATA
- TEST SYSTEM :
- Rodent - mouse
- DOSE/DURATION :
- 150 mg/kg
- REFERENCE :
- ACNSAX Activitas Nervosa Superior. (Avicenum, Malostranske nam. 28, Prague 1, Czechoslovakia) V.1- 1959- Volume(issue)/page/year: 15,114,1973
分子结构与计算化学数据
分子结构数据
1、 摩尔折射率：95.07
2、 摩尔体积（cm3/mol）：257.2
3、 等张比容（90.2K）：687.4
4、 表面张力（dyne/cm）：50.9
5、 极化率（10-24cm3）：37.68
