5-methyl-3-phenyl-3-prop-2-enyloxolan-2-one

5-methyl-3-phenyl-3-prop-2-enyloxolan-2-one 基本信息
CAS号 101833-09-4 分子式 C14H16O2
分子量 216.27600 精确质量  216.11500
PSA  26.30000 LogP  2.83590

基本信息 展开↓

CAS号:
101833-09-4
3D弹球模型:
立即前往扯扯看
分子式:
C14H16O2
分子量:
216.27600
英文名称:
5-methyl-3-phenyl-3-prop-2-enyloxolan-2-one
英文别名:
5-methyl-3-phenyl-3-prop-2-enyloxolan-2-one;
2-Methyl-4-phenyl-4-allyltetrahydrofuranone-5;
3-allyl-5-methyl-3-phenyl-dihydro-furan-2-one
精确分子量/精确质量:
216.11500
极性分子表面积/PSA:
26.30000
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。
InChI:
The Key: QEEZGNLDPXQOOA-UHFFFAOYSA-N

物化性质展开↓

密度:
1.039g/cm3
沸点:
349.9ºC at 760mmHg
闪点:
145.8ºC
折射率:
1.516
蒸汽压:
4.55E-05mmHg at 25°C

合成路线查看所有的合成路线

  • 242482-24-2

    methyl 2-phenyl-2-(prop-2-enyl)pent-4-enoate

  • ~77%

  • 101833-09-4

    5-methyl-3-phenyl-3-prop-2-enyloxolan-2-one

  • 150194-55-1

    150194-55-1

  • ~69%

  • 101833-09-4

    5-methyl-3-phenyl-3-prop-2-enyloxolan-2-one

  • 3563-57-3

    2-phenyl-2-prop-2-enylpent-4-enamide

  • 101833-09-4

    5-methyl-3-phenyl-3-prop-2-enyloxolan-2-one

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
LU3520500
CHEMICAL NAME :
2(3H)-Furanone, dihydro-3-allyl-5-methyl-3-phenyl-
CAS REGISTRY NUMBER :
101833-09-4
BEILSTEIN REFERENCE NO. :
0174524
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H16-O2
MOLECULAR WEIGHT :
216.30
WISWESSER LINE NOTATION :
T5OVTJ C2U1 CR& E1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
980 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 21,394,1966

上下游相关产品

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  • 242482-24-2

    methyl 2-phenyl-2-(prop-2-enyl)pent-4-enoate

  • 150194-55-1

    N/A

  • 3563-57-3

    2-phenyl-2-prop-2-enylpent-4-enamide

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