9H-Fluorene, 4-nitro-
- 中文别名:4-乙基-1-甲基-5H-吡啶并[4,3-b]吲哚-3-胺乙酸酯
- 中文释义:4-乙基-1-甲基-5H-吡啶并[4,3-b]吲哚-3-胺乙酸酯
- 英文别名:4-nitro-9H-fluorene;
9H-Fluorene,4-nitro;
4-Nitro-fluoren;
4-nitro-fluorene;
Fluorene,4-nitro
- CAS No.:24237-68-1
- 分子式:C13H9NO2
- 分子量:0
- 精确分子量:211.06300
- PSA:45.82000
- InChI:The Key: CYYBQMPZHMAEGT-UHFFFAOYSA-N
- 分子结构式:
物化性质
- 密度:
- 1.318g/cm3
- 沸点:
- 374.7ºC at 760 mmHg
- 闪点:
- 185.2ºC
- 折射率:
- 1.677
- 蒸汽压:
- 1.77E-05mmHg at 25°C
安全信息
- 密度:
- 1.318g/cm3
- 沸点:
- 374.7ºC at 760 mmHg
- 闪点:
- 185.2ºC
- 折射率:
- 1.677
- 蒸汽压:
- 1.77E-05mmHg at 25°C
毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- LL8040120
- CHEMICAL NAME :
- Fluorene, 4-nitro-
- CAS REGISTRY NUMBER :
- 24237-68-1
- BEILSTEIN REFERENCE NO. :
- 2973976
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C13-H9-N-O2
- MOLECULAR WEIGHT :
- 211.23
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
MUTATION DATA
- TYPE OF TEST :
- Cytogenetic analysis
- TEST SYSTEM :
- Rodent - hamster Lung
- DOSE/DURATION :
- 100 mg/L
- REFERENCE :
- MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 259,103,1991
海关数据
中国海关编码:2904209090
- 概述:
- 2904209090 其他仅含硝基或亚硝基的衍生物。监管条件:无。增值税率:17.0%。退税率:9.0%。最惠国关税:5.5%。普通关税:30.0%
- 申报要素:
- 品名, 成分含量, 用途
- 摘要/Summary:
- 2904209090 derivatives containing only nitro or only nitroso groups。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%
分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值(XlogP):3.4
2.氢键供体数量:0
3.氢键受体数量:2
4.可旋转化学键数量:0
5.互变异构体数量:无
6.拓扑分子极性表面积:45.8
7.重原子数量:16
8.表面电荷:0
9.复杂度:286
10.同位素原子数量:0
11.确定原子立构中心数量:0
12.不确定原子立构中心数量:0
13.确定化学键立构中心数量:0
14.不确定化学键立构中心数量:0
15.共价键单元数量:1
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