大麻色原烯

大麻色原烯 基本信息
CAS号 20675-51-8 分子式 C21H30O2
分子量 314.46200 精确质量  314.22500
PSA  29.46000 LogP  6.03560

基本信息 展开↓

CAS号:
20675-51-8
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分子式:
C21H30O2
分子量:
314.46200
中文名称:
大麻色原烯
英文名称:
2-Methyl-2-(4-methyl-3-penten-1-yl)-7-pentyl-2H-chromen-5-ol
中文别名:
大麻色原烯
英文别名:
2-Methyl-2-(4-methyl-3-penten-1-yl)-7-pentyl-2H-chromen-5-ol;
candoxatril;
cannabichromen
精确分子量/精确质量:
314.22500
极性分子表面积/PSA:
29.46000
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: UVOLYTDXHDXWJU-UHFFFAOYSA-N

物化性质展开↓

密度:
0.992g/cm3
沸点:
428.7ºC at 760mmHg
闪点:
174.2ºC

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DJ2930000
CHEMICAL NAME :
2H-1-Benzopyran-5-ol, 2-methyl-2-(4-methyl-3-pentenyl)-7-pentyl-
CAS REGISTRY NUMBER :
20675-51-8
LAST UPDATED :
198910
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C21-H30-O2
MOLECULAR WEIGHT :
314.51
WISWESSER LINE NOTATION :
T66 BO CHJ C3UY1&1 C1 GQ I5

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 :
113 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - changes in motor activity (specific assay) Behavioral - ataxia
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Primate - monkey
DOSE/DURATION :
270 mg/kg
TOXIC EFFECTS :
Behavioral - muscle contraction or spasticity Cardiac - arrhythmias (including changes in conduction) Lungs, Thorax, or Respiration - dyspnea
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
50 mg/kg
SEX/DURATION :
female 12 day(s) after conception
TOXIC EFFECTS :
Reproductive - Effects on Newborn - biochemical and metabolic

MUTATION DATA

TYPE OF TEST :
DNA inhibition
TEST SYSTEM :
Human Lymphocyte
DOSE/DURATION :
100 umol/L
REFERENCE :
FEPRA7 Federation Proceedings, Federation of American Societies for Experimental Biology. (Bethesda, MD) V.1-46, 1942-87. Volume(issue)/page/year: 36,1748,1977
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