萘福昔定

萘福昔定 基本信息
CAS号 1845-11-0 分子式 C29H31NO2
分子量 425.56200 精确质量  425.23500
PSA  21.70000 LogP  6.01300

基本信息 展开↓

CAS号:
1845-11-0
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立即前往扯扯看
分子式:
C29H31NO2
分子量:
425.56200
中文名称:
萘福昔定
英文名称:
1-[2-[4-(6-methoxy-2-phenyl-3,4-dihydronaphthalen-1-yl)phenoxy]ethyl]pyrrolidine
中文别名:
萘福昔定
英文别名:
1-[2-[4-(6-methoxy-2-phenyl-3,4-dihydronaphthalen-1-yl)phenoxy]ethyl]pyrrolidine;
Nafoxidine
精确分子量/精确质量:
425.23500
极性分子表面积/PSA:
21.70000
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: JEYWNNAZDLFBFF-UHFFFAOYSA-N

物化性质展开↓

密度:
1.137g/cm3
沸点:
574.5ºC at 760mmHg
闪点:
176.7ºC

安全信息展开↓

海关代码:
2933990090

合成路线查看所有的合成路线

  • 123-75-1

    四氢吡咯

  • +

  • 1449689-98-8

    1449689-98-8

  • ~85%

  • 1845-11-0

    萘福昔定

  • 5050-41-9

    N-(2-氯乙基)吡咯烷

  • +

  • 1729-38-0

    4-(6-methoxy-2-phenyl-3,4-dihydronaphthalen-1-yl)phenol

  • ~81%

  • 1845-11-0

    萘福昔定

  • 1729-38-0

    4-(6-methoxy-2-phenyl-3,4-dihydronaphthalen-1-yl)phenol

  • +

  • 7250-67-1

    N-(2-氯乙基)吡咯烷盐酸盐

  • ~79%

  • 1845-11-0

    萘福昔定

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UY0880000
CHEMICAL NAME :
Pyrrolidine, 1-(2-(p-(3,4-dihydro-6-methoxy-2-phenyl-1-naphthyl)ph enoxy)ethyl)-
CAS REGISTRY NUMBER :
1845-11-0
BEILSTEIN REFERENCE NO. :
1440873
LAST UPDATED :
199612
DATA ITEMS CITED :
8
MOLECULAR FORMULA :
C29-H31-N-O2
MOLECULAR WEIGHT :
425.61
WISWESSER LINE NOTATION :
L66 BUT&J CR& HO1 BR DO2- AT5NTJ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
500 ug/kg
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Reproductive - Tumorigenic effects - uterine tumors
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Parenteral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
200 ug/kg
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Reproductive - Tumorigenic effects - uterine tumors
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
500 ug/kg
SEX/DURATION :
female 1 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Maternal Effects - ovaries, fallopian tubes Reproductive - Maternal Effects - uterus, cervix, vagina Reproductive - Maternal Effects - other effects
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
250 ug/kg
SEX/DURATION :
female 1 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Maternal Effects - menstrual cycle changes or disorders
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intramuscular
DOSE :
3500 ug/kg
SEX/DURATION :
female 14 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Maternal Effects - uterus, cervix, vagina Reproductive - Maternal Effects - menstrual cycle changes or disorders Reproductive - Maternal Effects - other effects

MUTATION DATA

TEST SYSTEM :
Rodent - mouse
DOSE/DURATION :
400 mg/kg
REFERENCE :
CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 48,14,1988 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X4817 No. of Facilities: 3 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 6 (estimated) No. of Female Employees: 6 (estimated)

海关数据查看详细

中国海关编码:2933990090

概述:
2933990090. 其他仅含氮杂原子的杂环化合物. 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, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期
摘要/Summary:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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