(6-chloro-2H-chromen-3-yl)-(4-iminopyridin-1-yl)methanone

(6-chloro-2H-chromen-3-yl)-(4-iminopyridin-1-yl)methanone 基本信息
CAS号 83823-23-8 分子式 C15H11ClN2O2
分子量 286.71300 精确质量  286.05100
PSA  55.08000 LogP  2.83690

基本信息 展开↓

CAS号:
83823-23-8
3D弹球模型:
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分子式:
C15H11ClN2O2
分子量:
286.71300
英文名称:
(6-chloro-2H-chromen-3-yl)-(4-iminopyridin-1-yl)methanone
英文别名:
(6-chloro-2H-chromen-3-yl)-(4-iminopyridin-1-yl)methanone;
(6-chloro-2h-chromen-3-yl)(4-iminopyridin-1(4h)-yl)methanone;
1-((6-Chloro-2H-1-benzopyran-3-yl)carbonyl)-4(1H)-pyrimidinimine;
4(1H)-Pyrimidinimine,1-((6-chloro-2H-1-benzopyran-3-yl)carbonyl)
精确分子量/精确质量:
286.05100
极性分子表面积/PSA:
55.08000
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: XMMVIAWVYLIYRR-UHFFFAOYSA-N

物化性质展开↓

密度:
1.37g/cm3
沸点:
480.6ºC at 760 mmHg
闪点:
244.4ºC
折射率:
1.654

合成路线查看所有的合成路线

  • 29212-32-6

    pyridin-4-amine

  • +

  • 306935-54-6

    6-氯-2H-二苯并呋喃-3-羰酰氯

  • 83823-23-8

    (6-chloro-2H-chromen-3-yl)-(4-iminopyridin-1-yl)methanone

  • 83823-06-7

    6-氯-2H-苯并吡喃-3-碳酸

  • 83823-23-8

    (6-chloro-2H-chromen-3-yl)-(4-iminopyridin-1-yl)methanone

  • 83823-19-2

    6-chloro-2H-chromene-3-carboxamide

  • 83823-23-8

    (6-chloro-2H-chromen-3-yl)-(4-iminopyridin-1-yl)methanone

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UW5976090
CHEMICAL NAME :
4(1H)-Pyrimidinimine, 1-((6-chloro-2H-1-benzopyran-3-yl)carbonyl)-
CAS REGISTRY NUMBER :
83823-23-8
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H11-Cl-N2-O2
MOLECULAR WEIGHT :
286.73

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 :
150 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 21,344,1982

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  • 57543-67-6

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  • 83823-19-2

    6-chloro-2H-chromene-3-carboxamide

  • 83823-06-7

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  • 29212-32-6

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