2-methylindene-1,3-dione

2-methylindene-1,3-dione 基本信息
CAS号 876-83-5 分子式 C10H8O2
分子量 160.16900 精确质量  160.05200
PSA  34.14000 LogP  1.70170

基本信息 展开↓

CAS号:
876-83-5
3D弹球模型:
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分子式:
C10H8O2
分子量:
160.16900
中文名称:
2-methylindene-1,3-dione
英文名称:
2-methylindene-1,3-dione
中文别名:
2-methylindene-1,3-dione
英文别名:
2-methylindene-1,3-dione;
2-methylindane-1,3-dione;
1,3-Indandione,2-methyl;
2-Methyl-1,3-indanedione;
2-methyl-indene-1,3-dione;
2-methyl-indan-1,3-dione;
2-1,3-Methyl-indandion;
2-Methyl-1,3-indandione
精确分子量/精确质量:
160.05200
极性分子表面积/PSA:
34.14000
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: VBTBCNRVYWGDPP-UHFFFAOYSA-N

物化性质展开↓

密度:
1.217g/cm3
沸点:
300.2ºC at 760 mmHg
闪点:
112.1ºC
折射率:
1.574

安全信息展开↓

海关代码:
2914399090

合成路线查看所有的合成路线

  • 60626-82-6

    60626-82-6

  • ~97%

  • 876-83-5

    2-methylindene-1,3-dione

  • 131-11-3

    邻苯二甲酸二甲酯

  • +

  • 96-22-0

    二乙基酮

  • ~60%

  • 876-83-5

    2-methylindene-1,3-dione

  • 84-66-2

    邻苯二甲酸二乙酯

  • +

  • 96-22-0

    二乙基酮

  • ~51%

  • 876-83-5

    2-methylindene-1,3-dione

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NK5977000
CHEMICAL NAME :
1,3-Indandione, 2-methyl-
CAS REGISTRY NUMBER :
876-83-5
BEILSTEIN REFERENCE NO. :
1563677
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C10-H8-O2
MOLECULAR WEIGHT :
160.18
WISWESSER LINE NOTATION :
L56 BV DV CHJ C1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 33,191,1975 ** REPRODUCTIVE DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
DOSE :
25 mg/kg
SEX/DURATION :
female 9 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants) Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 33,191,1975

海关数据查看详细

中国海关编码:2914399090

概述:
2914399090. 其他不含其他含氧基的芳香酮. 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, 丙酮报明包装
摘要/Summary:
2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

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