Introduction：Basic information about CAS 16623-56-6|19H-2,3,7-[1,3]Butadien[1]yl[4]ylidene-9,12-etheno-14,18-metheno-4H-pyrido[2,3,4-tu]-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 19H-2,3,7-[1,3]Butadien[1]yl[4]ylidene-9,12-etheno-14,18-metheno-4H-pyrido[2,3,4-tu]-1,13,6-benzodioxaazacyclodocosine,5,6,7,8,19a,20,21,22-octahydro-15,24,25,31,32-pentamethoxy-6,20-dimethyl-,(7S,19a |
|---|
| CAS Number | 16623-56-6 | Molecular Weight | 652.77600 |
|---|
| Density | 1.175g/cm3 | Boiling Point | 739.9ºC at 760mmHg |
|---|
| Molecular Formula | C39H44N2O7 | Melting Point | / |
|---|
| MSDS | / | Flash Point | 181.1ºC |
|---|
Names
| Name | Thalidasine |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 1.175g/cm3 |
|---|
| Boiling Point | 739.9ºC at 760mmHg |
|---|
| Molecular Formula | C39H44N2O7 |
|---|
| Molecular Weight | 652.77600 |
|---|
| Flash Point | 181.1ºC |
|---|
| Exact Mass | 652.31500 |
|---|
| PSA | 71.09000 |
|---|
| LogP | 7.04680 |
|---|
| Vapour Pressure | 9.29E-22mmHg at 25°C |
|---|
| Index of Refraction | 1.58 |
|---|
| InChIKey | SVQMVSCWYACSCP-KYJUHHDHSA-N |
|---|
| SMILES | COc1ccc2cc1Oc1ccc(cc1)CC1c3cc(OC)c(OC)c(c3CCN1C)Oc1c(OC)c(OC)cc3c1C(C2)N(C)CC3 |
|---|
Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- XG2005000
- CHEMICAL NAME :
- Thalidasine
- CAS REGISTRY NUMBER :
- 16623-56-6
- LAST UPDATED :
- 199412
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C39-H44-N2-O7
- MOLECULAR WEIGHT :
- 652.85
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 520 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CTYAD8 Zhongcaoyao. Chinese Traditional and Herbal Medicine. (China International Book Trading Corp., POB 2820, Beijing, Peop. Rep. China) V.11- 1980- Volume(issue)/page/year: 11,217,1980
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 120 mg/kg
- TOXIC EFFECTS :
- Tumorigenic - active as anti-cancer agent
- REFERENCE :
- YHTPAD Yaoxue Tongbao. Bulletin of Pharmacology. (China International Book Trading Corp., POB 2820, Beijing, Peop. Rep. China) V.13-23, 1978-88. For publisher information, see ZYZAEU. Volume(issue)/page/year: 15(7),46,1980 ** OTHER MULTIPLE DOSE TOXICITY DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 2100 mg/kg/7D-I
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Behavioral - food intake (animal) Related to Chronic Data - death
- REFERENCE :
- CTYAD8 Zhongcaoyao. Chinese Traditional and Herbal Medicine. (China International Book Trading Corp., POB 2820, Beijing, Peop. Rep. China) V.11- 1980- Volume(issue)/page/year: 11,217,1980
|
Synonyms
| O-methyl-thalfoetidine |
| O-Methylthalfetidine |
| 6,6',7,7',12-Pentamethoxy-2,2'-dimethylthalidasan |
| Thalidasin |
| O-Methylthalfoetidin |
| O-methyl-thalrugosidine |
| Thalidusine,(S,S) |
| 6,7,12,6',7'-pentamethoxy-2,2'-dimethyl-thalidasane |
