4-(1-甲基乙基)-苯乙醛

4-(1-甲基乙基)-苯乙醛 基本信息
CAS号 4395-92-0 分子式 C11H14O
分子量 162.22800 精确质量  162.10400
PSA  17.07000 LogP  2.55140

基本信息 展开↓

CAS号:
4395-92-0
3D弹球模型:
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分子式:
C11H14O
分子量:
162.22800
中文名称:
4-(1-甲基乙基)-苯乙醛
英文名称:
2-(4-propan-2-ylphenyl)acetaldehyde
中文别名:
4-(1-甲基乙基)-苯乙醛;
4-异丙基苯基乙醛
英文别名:
2-(4-propan-2-ylphenyl)acetaldehyde;
Isopropylphenylacetaldehyde,p;
para-isopropyl phenylacetaldehyde;
2-[4-(1-methylethyl)phenyl]-ethanal;
P-Cymene-7-carboxaldehyde;
(4-Isopropyl-phenyl)-acetaldehyd;
Cuminic acetaldehyde;
Cortexal;
(4-isopropyl-phenyl)-ethanal;
p-isopropyl phenylacetaldehyde;
FEMA No. 2954;
4-isopropyl-1-benzeneacetaldehyde;
Cumyl acetaldehyde;
Benzeneacetaldehyde,4-(1-methylethyl);
4-Isopropyl phenylacetaldehyde
精确分子量/精确质量:
162.10400
极性分子表面积/PSA:
17.07000
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:
224-522-5
InChI:
The Key: FSKGFRBHGXIDSA-UHFFFAOYSA-N

物化性质展开↓

密度:
0.956g/cm3
沸点:
246.9ºC at 760 mmHg
闪点:
112.3ºC
折射率:
1.503

安全信息展开↓

海关代码:
2912299000

合成路线查看所有的合成路线

  • 93805-69-7

    ethyl 3-(4-propan-2-ylphenyl)oxirane-2-carboxylate

  • 4395-92-0

    4-(1-甲基乙基)-苯乙醛

  • 122-51-0

    原甲酸三乙酯

  • 4395-92-0

    4-(1-甲基乙基)-苯乙醛

  • 64-18-6

    Formic acid

  • +

  • 122-03-2

    4-异丙基苯甲醛

  • 4395-92-0

    4-(1-甲基乙基)-苯乙醛

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AB2920000
CHEMICAL NAME :
Acetaldehyde, (p-isopropylphenyl)-
CAS REGISTRY NUMBER :
4395-92-0
BEILSTEIN REFERENCE NO. :
2246668
LAST UPDATED :
199701
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C11-H14-O
MOLECULAR WEIGHT :
162.25
WISWESSER LINE NOTATION :
VH1R DY1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 17,533,1979 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
4100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 17,533,1979
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 17,533,1979 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - T0032 No. of Facilities: 15 (estimated) No. of Industries: 1 No. of Occupations: 16 No. of Employees: 2279 (estimated)

海关数据查看详细

中国海关编码:2912299000

概述:
2912299000. 其他不含其他含氧基的环醛. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:5.5%. 普通关税:30.0%
申报要素:
品名, 成分含量, 用途, 四聚甲醛报明外观
摘要/Summary:
2912299000. other cyclic aldehydes without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

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    ethyl 3-(4-propan-2-ylphenyl)oxirane-2-carboxylate

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