丙烯酸-2,3-环氧丙酯十八烯酸

丙烯酸-2,3-环氧丙酯十八烯酸 基本信息
CAS号 5431-33-4 分子式 C21H38O3
分子量 338.52500 精确质量  338.28200
PSA  38.83000 LogP  5.96590

基本信息 展开↓

CAS号:
5431-33-4
3D弹球模型:
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分子式:
C21H38O3
分子量:
338.52500
中文名称:
丙烯酸-2,3-环氧丙酯十八烯酸
英文名称:
oxiran-2-ylmethyl (Z)-octadec-9-enoate
中文别名:
丙烯酸-2,3-环氧丙酯十八烯酸;
油酸缩水甘油酯
英文别名:
oxiran-2-ylmethyl (Z)-octadec-9-enoate;
2,3-Epoxypropyl oleate;
Oxiranylmethyl ester of 9-octadecenoic acid;
2,3-Epoxypropyl ester of oleic acid;
Oleic acid glycidyl ester;
Glycidyl octadecenoate;
Glycidyl oleate;
(rac)-(+/-)-2-(oleoyloxymethyl)oxirane;
Glycidol oleate;
(+-)-Oelsaeure-(2,3-epoxy-propylester);
Oleic acid,2,3-epoxypropyl ester;
2,3-Epoxy-1-propanol oleate;
2-(oleoyloxymethyl)oxirane
精确分子量/精确质量:
338.28200
极性分子表面积/PSA:
38.83000
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:
226-588-0
InChI:
The Key: VWYIWOYBERNXLX-KTKRTIGZSA-N

物化性质展开↓

密度:
0.941g/cm3
沸点:
430.3ºC at 760mmHg
闪点:
163.7ºC
折射率:
1.472

合成路线查看所有的合成路线

  • 112-77-6

    油酰氯

  • +

  • 556-52-5

    (±)-环氧丙醇

  • ~88%

  • 5431-33-4

    丙烯酸-2,3-环氧丙酯十八烯酸

  • 112-80-1

    油酸

  • +

  • 556-52-5

    (±)-环氧丙醇

  • ~72%

  • 5431-33-4

    丙烯酸-2,3-环氧丙酯十八烯酸

  • 143-19-1

    油酸钠

  • +

  • 106-89-8

    环氧氯丙烷

  • 5431-33-4

    丙烯酸-2,3-环氧丙酯十八烯酸

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RK0700000
CHEMICAL NAME :
Oleic acid, 2,3-epoxypropyl ester
CAS REGISTRY NUMBER :
5431-33-4
LAST UPDATED :
199710
DATA ITEMS CITED :
9
MOLECULAR FORMULA :
C21-H38-O3
MOLECULAR WEIGHT :
338.59
WISWESSER LINE NOTATION :
T3OTJ B1OV8U9

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 :
3520 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
8 gm/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 :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1040 mg/kg/52W-I
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Lungs, Thorax, or Respiration - tumors Blood - leukemia

MUTATION DATA

TEST SYSTEM :
Rodent - rat
DOSE/DURATION :
1 gm/kg
REFERENCE :
BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK) V.1-33, 1946-68. For publisher information, see BJPCBM. Volume(issue)/page/year: 6,235,1951 *** REVIEWS *** IARC Cancer Review:Animal Inadequate 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: 11,183,1976 IARC Cancer Review:Human No Adequate Data 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: 11,183,1976 IARC Cancer Review:Group 3 IMSUDL IARC Monographs, Supplement. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) No.1- 1979- Volume(issue)/page/year: 7,56,1987 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - M0777 No. of Facilities: 84 (estimated) No. of Industries: 2 No. of Occupations: 10 No. of Employees: 1746 (estimated)

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