2-anilino-N-ethyl-6-methylpyridine-3-carboxamide

2-anilino-N-ethyl-6-methylpyridine-3-carboxamide 基本信息
CAS号 78593-73-4 分子式 C15H17N3O
分子量 255.31500 精确质量  255.13700
PSA  57.51000 LogP  3.53110

基本信息 展开↓

CAS号:
78593-73-4
3D弹球模型:
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分子式:
C15H17N3O
分子量:
255.31500
中文名称:
2-anilino-N-ethyl-6-methylpyridine-3-carboxamide
英文名称:
2-anilino-N-ethyl-6-methylpyridine-3-carboxamide
中文别名:
2-anilino-N-ethyl-6-methylpyridine-3-carboxamide
英文别名:
2-anilino-N-ethyl-6-methylpyridine-3-carboxamide;
2-Anilino-N-ethyl-6-methylnicotinamide;
Nicotinamide,2-anilino-N-ethyl-6-methyl
精确分子量/精确质量:
255.13700
极性分子表面积/PSA:
57.51000
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: DBPJBGGAFKSAML-UHFFFAOYSA-N

物化性质展开↓

密度:
1.15g/cm3
沸点:
419ºC at 760 mmHg
闪点:
207.2ºC
折射率:
1.608

合成路线查看所有的合成路线

  • 78593-69-8

    2-Chloro-6-methylnicotinic acid ethylamide

  • +

  • 74497-02-2

    1-aminobenzene

  • ~59%

  • 78593-73-4

    2-anilino-N-ethyl-6-methylpyridine-3-carboxamide

  • 39853-81-1

    2-氯-6-甲基烟酰氯

  • 78593-73-4

    2-anilino-N-ethyl-6-methylpyridine-3-carboxamide

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QS4000950
CHEMICAL NAME :
Nicotinamide, 2-anilino-N-ethyl-6-methyl-
CAS REGISTRY NUMBER :
78593-73-4
LAST UPDATED :
199803
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H17-N3-O
MOLECULAR WEIGHT :
255.35
WISWESSER LINE NOTATION :
T6NJ BMR& CVM2 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 :
390 mg/kg
TOXIC EFFECTS :
Brain and Coverings - recordings from specific areas of CNS Autonomic Nervous System - smooth muscle relaxant (mechanism undefined, spasmolytic)
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 15,249,1981

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  • 78593-69-8

    2-Chloro-6-methylnicotinic acid ethylamide

  • 39853-81-1

    2-氯-6-甲基烟酰氯

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