2-methoxy-6-methylcyclohexa-2,5-diene-1,4-dione

2-methoxy-6-methylcyclohexa-2,5-diene-1,4-dione 基本信息
CAS号 611-68-7 分子式 C8H8O3
分子量 152.14700 精确质量  152.04700
PSA  43.37000 LogP  0.61480

基本信息 展开↓

CAS号:
611-68-7
3D弹球模型:
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分子式:
C8H8O3
分子量:
152.14700
中文名称:
2-methoxy-6-methylcyclohexa-2,5-diene-1,4-dione
英文名称:
2-methoxy-6-methylcyclohexa-2,5-diene-1,4-dione
中文别名:
2-methoxy-6-methylcyclohexa-2,5-diene-1,4-dione
英文别名:
2-methoxy-6-methylcyclohexa-2,5-diene-1,4-dione;
2,5-Cyclohexadiene-1,4-dione,2-methoxy-6-methyl;
3-Methoxy-2,5-toluquinone;
4-Methoxy-toluoquinone;
p-Benzoquinone,2-methoxy-6-methyl;
2-Methoxy-6-methyl-[1,4]benzochinon;
2-methoxy-6-methyl-p-benzoquinone;
2-Methoxy-6-methyl-1,4-benzoquinone;
2-methoxy-6-methylbenzo-1,4-quinone
精确分子量/精确质量:
152.04700
极性分子表面积/PSA:
43.37000
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: HVGWDVJUMODUIZ-UHFFFAOYSA-N

物化性质展开↓

密度:
1.17g/cm3
沸点:
255.2ºC at 760 mmHg
闪点:
109.4ºC
折射率:
1.505

合成路线查看所有的合成路线

  • 104113-84-0

    苯酚, 4-[(二甲氨基)甲基]-2-甲氧基-6-甲基-

  • ~93%

  • 611-68-7

    2-methoxy-6-methylcyclohexa-2,5-diene-1,4-dione

  • 2896-67-5

    2-甲氧基-6-甲基苯酚

  • ~89%

  • 611-68-7

    2-methoxy-6-methylcyclohexa-2,5-diene-1,4-dione

  • 3209-13-0

    3-甲氧基-5-甲基苯酚

  • ~87%

  • 611-68-7

    2-methoxy-6-methylcyclohexa-2,5-diene-1,4-dione

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DK6140000
CHEMICAL NAME :
p-Benzoquinone, 2-methoxy-6-methyl-
CAS REGISTRY NUMBER :
611-68-7
BEILSTEIN REFERENCE NO. :
2046069
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C8-H8-O3
MOLECULAR WEIGHT :
152.16
WISWESSER LINE NOTATION :
L6V DVJ BO1 F1

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 :
7400 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JANTAJ Journal of Antibiotics. (Japan Antibiotics Research Assoc., 2-20-8 Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan) V.2-5, 1948-52; V.21- 1968- Volume(issue)/page/year: 35,985,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
25 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85GDA2 "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980- Volume(issue)/page/year: 3,304,1980

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