5-chloro-3-methyl-1,3-benzoxazol-2-imine

5-chloro-3-methyl-1,3-benzoxazol-2-imine 基本信息
CAS号 64037-23-6 分子式 C8H7ClN2O
分子量 182.60700 精确质量  182.02500
PSA  41.92000 LogP  2.00390

基本信息 展开↓

CAS号:
64037-23-6
3D弹球模型:
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分子式:
C8H7ClN2O
分子量:
182.60700
中文名称:
5-chloro-3-methyl-1,3-benzoxazol-2-imine
英文名称:
5-chloro-3-methyl-1,3-benzoxazol-2-imine
中文别名:
5-chloro-3-methyl-1,3-benzoxazol-2-imine
英文别名:
5-chloro-3-methyl-1,3-benzoxazol-2-imine;
5-Chloro-2-imino-3-methylbenzoxazoline;
BENZOXAZOLINE,5-CHLORO-2-IMINO-3-METHYL;
2(3H)-Benzoxazolimine,5-chloro-3-methyl;
5-chloro-3-methyl-3H-benzoxazol-2-one-imine;
5-Chlor-3-methyl-3H-benzoxazol-2-on-imin
精确分子量/精确质量:
182.02500
极性分子表面积/PSA:
41.92000
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: IHHFWUALAIRFQB-UHFFFAOYSA-N

物化性质展开↓

密度:
1.44g/cm3
沸点:
267.2ºC at 760mmHg
闪点:
115.4ºC
折射率:
1.645

安全信息展开↓

海关代码:
2934999090

合成路线查看所有的合成路线

  • 61-80-3

    2-氨基-5-氯苯并噁唑

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  • 74-88-4

    甲基碘

  • 64037-23-6

    5-chloro-3-methyl-1,3-benzoxazol-2-imine

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DM4891000
CHEMICAL NAME :
Benzoxazoline, 5-chloro-2-imino-3-methyl-
CAS REGISTRY NUMBER :
64037-23-6
BEILSTEIN REFERENCE NO. :
0140953
LAST UPDATED :
199712
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C8-H7-Cl-N2-O
MOLECULAR WEIGHT :
182.62
WISWESSER LINE NOTATION :
T56 BNYOJ B1 CUM HG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
MDCHAG Medicinal Chemistry: A Series of Monographs. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1963- Volume(issue)/page/year: 4(1),339,1964
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
MDCHAG Medicinal Chemistry: A Series of Monographs. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1963- Volume(issue)/page/year: 4(1),337,1964
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
120 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
MDCHAG Medicinal Chemistry: A Series of Monographs. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1963- Volume(issue)/page/year: 4(1),337,1964

海关数据查看详细

中国海关编码:2934999090

概述:
2934999090. 其他杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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