1-呋喃-3-基-4-甲基-1-戊酮

1-呋喃-3-基-4-甲基-1-戊酮 基本信息
CAS号 553-84-4 分子式 C10H14O2
分子量 166.21700 精确质量  166.09900
PSA  30.21000 LogP  2.89850

基本信息 展开↓

CAS号:
553-84-4
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分子式:
C10H14O2
分子量:
166.21700
中文名称:
1-呋喃-3-基-4-甲基-1-戊酮
英文名称:
1-(furan-3-yl)-4-methylpentan-1-one
中文别名:
1-呋喃-3-基-4-甲基-1-戊酮
英文别名:
1-(furan-3-yl)-4-methylpentan-1-one;
Perilla ketone;
1-furan-3-yl-4-methyl-pentan-1-one;
Purple mint plant extract
精确分子量/精确质量:
166.09900
极性分子表面积/PSA:
30.21000
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: LVHLZMUFIYAEQB-UHFFFAOYSA-N

物化性质展开↓

密度:
0.976g/cm3
沸点:
224.4ºC at 760mmHg
闪点:
96.8ºC
折射率:
1.465

安全信息展开↓

海关代码:
2932190090

合成路线查看所有的合成路线

  • 38136-29-7

    异己酰氯

  • +

  • 87453-06-3

    tributyl(furan-3-yl)stannane

  • ~74%

  • 553-84-4

    1-呋喃-3-基-4-甲基-1-戊酮

  • 26214-65-3

    3-呋喃甲酰氯

  • +

  • 35061-27-9

    diisopentyl cadmium

  • 553-84-4

    1-呋喃-3-基-4-甲基-1-戊酮

  • 107-82-4

    1-溴-3-甲基丁烷

  • 553-84-4

    1-呋喃-3-基-4-甲基-1-戊酮

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SA8935000
CHEMICAL NAME :
1-Pentanone, 1-(3-furanyl)-4-methyl-
CAS REGISTRY NUMBER :
553-84-4
BEILSTEIN REFERENCE NO. :
0114624
LAST UPDATED :
199612
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C10-H14-O2
MOLECULAR WEIGHT :
166.24
WISWESSER LINE NOTATION :
T5OJ CV2Y1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
10 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
SCIEAS Science. (American Assoc. for the Advancement of Science, 1333 H St., NW, Washington, DC 20005) V.1- 1895- Volume(issue)/page/year: 197,573,1977
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2500 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
SCIEAS Science. (American Assoc. for the Advancement of Science, 1333 H St., NW, Washington, DC 20005) V.1- 1895- Volume(issue)/page/year: 197,573,1977
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
106 mg/kg
TOXIC EFFECTS :
Lungs, Thorax, or Respiration - chronic pulmonary edema
REFERENCE :
JANSAG Journal of Animal Science. (American Soc. of Animal Science, 309 W. Clark St., Champaign, IL 61820) V.1- 1942- Volume(issue)/page/year: 60,248,1985
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
14 mg/kg
TOXIC EFFECTS :
Lungs, Thorax, or Respiration - chronic pulmonary edema
REFERENCE :
JANSAG Journal of Animal Science. (American Soc. of Animal Science, 309 W. Clark St., Champaign, IL 61820) V.1- 1942- Volume(issue)/page/year: 60,248,1985
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - hamster
DOSE/DURATION :
13700 ug/kg
TOXIC EFFECTS :
Lungs, Thorax, or Respiration - chronic pulmonary edema
REFERENCE :
JANSAG Journal of Animal Science. (American Soc. of Animal Science, 309 W. Clark St., Champaign, IL 61820) V.1- 1942- Volume(issue)/page/year: 60,248,1985
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Mammal - domestic
DOSE/DURATION :
10 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 45,300,1978

海关数据查看详细

中国海关编码:2932190090

概述:
2932190090 其他结构上有非稠合呋喃环化合物. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:20.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
2932190090 other compounds containing an unfused furan ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%

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