4A,5,8,8a-四氢-[1,4]萘醌

4A,5,8,8a-四氢-[1,4]萘醌 基本信息
CAS号 6271-40-5 分子式 C10H10O2
分子量 162.18500 精确质量  162.06800
PSA  34.14000 LogP  1.27680

基本信息 展开↓

CAS号:
6271-40-5
3D弹球模型:
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分子式:
C10H10O2
分子量:
162.18500
中文名称:
4A,5,8,8a-四氢-[1,4]萘醌
英文名称:
4A,5,8,8a-Tetrahydro-[1,4]naphthoquinone
中文别名:
4A,5,8,8a-四氢-[1,4]萘醌
英文别名:
4A,5,8,8a-Tetrahydro-[1,4]naphthoquinone;
4a,5,8,8a-Tetrahydro-1,4-naphthoquinone;
1,4-Naphthalenedione,4A,5,8,8A-tetrahydro;
1,4-Naphthoquinone,4A,5,8,8A-tetrahydro;
4a,5,8,8a-tetrahydronaphtho-1,4-quinone;
5,8,9,10-tetrahydro-1,4-naphthoquinone;
4a,5,5,8a-tetrahydro-1,4-naphthoquinone;
4a,5,8,8a-tetrahydronaphthoquinone-1,4-dione;
Wln: L66 bv ev cu hutj
精确分子量/精确质量:
162.06800
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: RLUZSEVUJQNQNV-UHFFFAOYSA-N

物化性质展开↓

密度:
1.175g/cm3
沸点:
295.1ºC at 760mmHg
闪点:
110.1ºC

合成路线查看所有的合成路线

  • 106-99-0

    1,3-丁二烯

  • +

  • 106-51-4

    苯醌

  • ~94%

  • 6271-40-5

    4A,5,8,8a-四氢-[1,4]萘醌

  • 106-99-0

    1,3-丁二烯

  • +

  • 106-51-4

    苯醌

  • +

  • 71-43-2

  • 6271-40-5

    4A,5,8,8a-四氢-[1,4]萘醌

  • 590-19-2

    1,2-丁二烯

  • +

  • 106-51-4

    苯醌

  • 6271-40-5

    4A,5,8,8a-四氢-[1,4]萘醌

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QL9450000
CHEMICAL NAME :
1,4-Naphthoquinone, 4a,5,8,8a-tetrahydro-
CAS REGISTRY NUMBER :
6271-40-5
LAST UPDATED :
199112
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H10-O2
MOLECULAR WEIGHT :
162.20
WISWESSER LINE NOTATION :
L66 BV EV CU HUTJ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
125 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 6,224,1954

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