1(3H)-Isobenzofuranone,3-(3-furanyl)-3a,4,5,6-tetrahydro-3a,7-dimethyl-, (3R,3aR)-
- 中文别名：梣酮; 3-(3-呋喃基)-3a,4,5,6-四氢-3a,7-二甲基苯酞
- 中文释义：梣酮;酮
- 英文别名：FRAXINELLONE;
(3R,3aR)-3-(3-Furyl)-3a,7-dimethyl-3a,4,5,6-tetrahydro-2-benzofuran-1(3H)-one;
1(3H)-isobenzofuranone, 3-(3-furanyl)-3a,4,5,6-tetrahydro-3a,7-dimethyl-, (3R,3aR)-;
(3R,3aR)-3-(furan-3-yl)-3a,7-dimethyl-3a,4,5,6-tetrahydro-2-benzofuran-1(3H)-one;
fraxinellone;
methyl phenylmethanesulfonate;
Methyl toluenesulfonate;
O/P-Toluenesulfonic acid methyl ester;
methyl toluenesulphonate;
4,5,6,7-tetrahydrothieno [3,2-c]pyridine hcl;
4,5,6,7-tetrahydrothieno[3,2-c]pyridine hydrochloride (1:1);
4,5,6,7-Terahydro-thieno(3,2-c) pyridine HCl;
4,5,6.7-Tetrahydro-thienol[3,2-c]pyridine HCl;
4,5,6,7-Tetrahydrothiophene[3,2-c]pyridine hydrochloride;
4,5,6,7-Tetrahydro-thieno[3,2-c]pyridine hydrochloride;
4,5,6,7-Tetrahydrothieno[3,2,c]pyridine hydrochloride
- CAS No.：28808-62-0
- 分子式：
C14H16O3
- 分子量：232.28
- 精确分子量：232.11000
- PSA：39.44000
- InChI：InChI=1/C14H16O3/c1-9-4-3-6-14(2)11(9)13(15)17-12(14)10-5-7-16-8-10/h5,7-8,12H,3-4,6H2,1-2H3/t12-,14+/m0/s1
- 分子结构式：
物化性质
- 密度：
- 1.18 g/cm3
- 熔点：
- 116ºC
- 沸点：
- 372.9ºC at 760 mmHg
- 闪点：
- 179.3ºC
- 折射率：
- 1.552
- 蒸汽压：
- 9.29E-06mmHg at 25°C
安全信息
- 密度：
- 1.18 g/cm3
- 熔点：
- 116ºC
- 沸点：
- 372.9ºC at 760 mmHg
- 闪点：
- 179.3ºC
- 折射率：
- 1.552
- 蒸汽压：
- 9.29E-06mmHg at 25°C
毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- TI3767000
- CHEMICAL NAME :
- Phthalide, 3-(3-furyl)-3a,4,5,6-tetrahydro-3a,7-dimethyl-
- CAS REGISTRY NUMBER :
- 28808-62-0
- LAST UPDATED :
- 198910
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C14-H16-O3
- MOLECULAR WEIGHT :
- 232.30
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 274 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PLMEAA Planta Medica. (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart 1, Fed. Rep. Ger.) V.1- 1953- Volume(issue)/page/year: 53,399,1987
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 116 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PLMEAA Planta Medica. (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart 1, Fed. Rep. Ger.) V.1- 1953- Volume(issue)/page/year: 53,399,1987
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 430 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PLMEAA Planta Medica. (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart 1, Fed. Rep. Ger.) V.1- 1953- Volume(issue)/page/year: 53,399,1987
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 355 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PLMEAA Planta Medica. (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart 1, Fed. Rep. Ger.) V.1- 1953- Volume(issue)/page/year: 53,399,1987 ** REPRODUCTIVE DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 424 mg/kg
- SEX/DURATION :
- female 5-8 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Fertility - female fertility index (e.g. # females pregnant per # sperm positive females; # females pregnant per # females mated)
- REFERENCE :
- PLMEAA Planta Medica. (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart 1, Fed. Rep. Ger.) V.1- 1953- Volume(issue)/page/year: 53,399,1987
