双醋炔诺醇

双醋炔诺醇 基本信息
CAS号 297-76-7 分子式 C24H32O4
分子量 384.50800 精确质量  384.23000
PSA  52.60000 LogP  4.42590

等价的CAS号:

297-76-7,6785-71-3,20521-31-7,23944-84-5,23944-85-6,61217-13-8

基本信息 展开↓

CAS号:
297-76-7
3D弹球模型:
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分子式:
C24H32O4
分子量:
384.50800
中文名称:
双醋炔诺醇
英文名称:
ethynodiol diacetate
中文别名:
双醋炔诺醇;
Cyclopentadecane;
BRN 0111811;
JM 1498;
NSC 180811;
1,4,8,11-tetraazoniacyclotetradecane;
1,4,8,11-Tetraazacyclotetradecane;
CROWN ETHER/12-CROWN-4;
12-Crown-4;
三乙基二胺;
1,4-二氮杂二环[2.2.2]辛烷;
benzoxazol;
benzoxazole;
Phenoxathrin;
Phenoxthin;
USAF DO-17;
Dibenzooxathiane;
phenoxathiine;
vulkacitzm;
zenite;
zenitespecial;
zinc2-benzothiazolethiolate;
zincbenzothiazol-2-ylthiolate;
zinc bis(1,3-benzothiazole-2-thiolate);
2-benzothiazolethiol, zinc salt (1:1);
Rubber Accelerator ZMBT;
Rubber Accelerator MZ;
Accelerator MZ;
ACCELERATOR ZMBT;
ACCELERATOR ZMBT(MZ);
zinc di(benzothiazol-2-yl) disulphide;
Solfametopirazina;
Solfametopirazina [DCIT];
Sulfalen;
Sulfaleno;
Sulfaleno [INN-Spanish];
Sulfalenum;
Sulfalenum [INN-Latin];
Sulfamethopyrazine;
Sulfamethox;
Sulfalene;
Daltolite fast blue B;
Duratint blue 1001;
EM blue NCB;
eta-Copper phthalocyanine;
Euvinyl blue 702;
Fast;
Pigment Blue 15:3;
Erythromycin
英文别名:
ethynodiol diacetate;
Femulen;
ETHYNODIOL DIACETATE;
Metrodiol diacetate;
[(3S,8R,9S,10R,13S,14S,17R)-17-acetyloxy-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate;
Luto-metrodiol;
Ethynodiol diacetate;
3β,17β-Diacetoxy-17α-ethynyl-4-estrene;
Ovulen 50;
Ethinodiol diacetate;
17a-Ethynyl-4-estren-3b,17-diol diacetate;
Ovulen;
Cervicundin;
Continuin;
Metrodiol
精确分子量/精确质量:
384.23000
极性分子表面积/PSA:
52.60000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
EINECS:
206-044-9
InChI:
InChI=1/C24H32O4/c1-5-16-13-22-21-8-6-17-12-18(27-14(2)25)7-9-19(17)20(21)10-11-24(22,4)23(16)28-15(3)26/h1,12,16,18-23H,6-11,13H2,2-4H3/t16-,18+,19?,20?,21?,22?,23+,24+/m1/s1

物化性质展开↓

密度:
1.14 g/cm3
熔点:
128 - 131ºC
沸点:
461.1ºC at 760 mmHg
闪点:
221.8ºC
折射率:
1.544
蒸汽压:
8.11E-09mmHg at 25°C

安全信息展开↓

危险类别码:
R20/21/22
安全说明:
22-36
危险标志:
Xn: Harmful;

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RC8963000
CHEMICAL NAME :
19-Nor-17-alpha-pregn-4-en-20-yne-3-beta,17-diol diacetate
CAS REGISTRY NUMBER :
297-76-7
LAST UPDATED :
199510
DATA ITEMS CITED :
17
MOLECULAR FORMULA :
C24-H32-O4
MOLECULAR WEIGHT :
384.56
WISWESSER LINE NOTATION :
L E5 B666 MUTJ E1 FOV1 F1UU1 OOV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
840 ug/kg
SEX/DURATION :
female 21 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Fertility - other measures of fertility
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
840 ug/kg
SEX/DURATION :
female 24 week(s) pre-mating
TOXIC EFFECTS :
Reproductive - Maternal Effects - menstrual cycle changes or disorders
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
700 ug/kg
SEX/DURATION :
female 14 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Maternal Effects - uterus, cervix, vagina
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
6 mg/kg
SEX/DURATION :
male 30 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Paternal Effects - testes, epididymis, sperm duct Reproductive - Paternal Effects - prostate, seminal vesicle, Cowper's gland, accessory glands
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Administration onto the skin
DOSE :
240 mg/kg
SEX/DURATION :
male 30 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Paternal Effects - testes, epididymis, sperm duct Reproductive - Paternal Effects - prostate, seminal vesicle, Cowper's gland, accessory glands
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
16500 ug/kg
SEX/DURATION :
male 60 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Paternal Effects - testes, epididymis, sperm duct Reproductive - Paternal Effects - prostate, seminal vesicle, Cowper's gland, accessory glands
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
48 mg/kg
SEX/DURATION :
male 12 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Paternal Effects - spermatogenesis (incl. genetic material, sperm morphology, motility, and count)
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
1400 ug/kg
SEX/DURATION :
female 14 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Maternal Effects - ovaries, fallopian tubes
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
140 mg/kg
SEX/DURATION :
female 14 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Maternal Effects - uterus, cervix, vagina
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
120 ug/kg
SEX/DURATION :
female 3 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Maternal Effects - uterus, cervix, vagina
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
1560 ug/kg
SEX/DURATION :
female 1-3 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - female fertility index (e.g. # females pregnant per # sperm positive females; # females pregnant per # females mated)
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
5 mg/kg
SEX/DURATION :
female 1 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Fertility - other measures of fertility
TYPE OF TEST :
Mutation test systems - not otherwise specified

MUTATION DATA

TYPE OF TEST :
Cytogenetic analysis
TEST SYSTEM :
Mammal - cattle Cells - not otherwise specified
DOSE/DURATION :
10 mg/L
REFERENCE :
AJOGAH American Journal of Obstetrics and Gynecology. (C.V. Mosby Co., 11830 Westline Industrial Dr., St. Louis, MO 63146) V.1- 1920- Volume(issue)/page/year: 120,390,1974 *** REVIEWS *** IARC Cancer Review:Animal Limited Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 21,387,1979
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