呋喃-2,5二羧酸 | 3238-40-2
中文名称:
呋喃-2,5二羧酸
英文名称:
2,5-Furandicarboxylic acid
CAS No.:
3238-40-2
分子式:
C6 H4 O5
分子量:
156.09296
名称和标识符
MDL
MFCD00016582
InChIKey
CHTHALBTIRVDBM-UHFFFAOYSA-N
Inchi
1S/C6H4O5/c7-5(8)3-1-2-4(11-3)6(9)10/h1-2H,(H,7,8)(H,9,10)
SMILES
OC(=O)c1ccc(o1)C(=O)O
别名信息
- 中文别名 -
呋喃-2,5二羧酸
2,5-呋喃二甲酸
2,5-呋喃二羧酸
2,5-Furandicarboxylic Acid 2,5-呋喃二羧酸
呋喃-2,5-二甲酸
- 英文别名 -
2,5-Furandicarboxylic acid
Furan-2,5-dicarboxylic acid
2,5-dicarboxyfuran
2,5-furandicarboxylate
Dehydromucate
Dehydromucic acid
Dehydroschleimsaeure
furan-2,5-dicarbonsaeure
FDCA
2, 5-Furandicarboxylic acid
Furane-a,a'-dicarboxylic acid
Furane-.alpha.,.alpha.'-dicarboxylic acid
NSC40740
F0710
2,5-Furandicarboxylic acid, 97%
2,5-Furandicarboxylicacid
1-BOC-3-([(4-TRIFLUOROMETHYL-PHENYL)-AMINO]-METHYL)-AZETIDINE
Furane-alpha,alpha'-dicarboxylic acid
AM20090470
AC-22967
UNII-73C4JJ695C
DTXSID0062927
Furan 2,5-dicarboxylate
CS-W002105
2,5 furan dicarboxylic acid
Furan-2,5-Dicarboxylicacid
FT-0600520
7FN
Furane-a,a'-dicarboxylate
Q4596798
SY016939
EC 221-800-8
AR-360/40225989
Furan 2,5-dicarboxylic acid
2,5-furan dicarboxylic acid
C20450
MFCD00016582
NSC 40740
SCHEMBL38726
BCP16192
AKOS005169851
EN300-110895
GEO-01437
A5809
NS00006168
PS-8853
Q-102496
CHEBI:84212
EINECS 221-800-8
Z1255427253
73C4JJ695C
Furane-2,5-dicarboxylic acid
NSC-40740
s6320
3238-40-2
HY-W002105
2,5-Furandicarboxylic acid,99%
物化性质
实验特性
LogP
0.67600
PSA
87.74000
折射率
1.6400 (estimate)
沸点
419.2℃ at 760 mmHg
熔点
>300 °C
闪点
419.2°C at760mmHg
颜色与性状
White to Yellow Solid
稳定性
Light Sensitive, Very Hygroscopic
溶解性
无可用
密度
1.7400
计算特性
精确分子量
156.00600
氢键供体数量
2
氢键受体数量
5
可旋转化学键数量
2
同位素质量
156.006
重原子数量
11
复杂度
167
同位素原子数量
0
确定原子立构中心数量
0
不确定原子立构中心数量
0
确定化学键立构中心数量
0
不确定化学键立构中心数量
0
共价键单元数量
1
疏水参数计算参考值(XlogP)
0.7
互变异构体数量
无
表面电荷
0
拓扑分子极性表面积
87.7A^2
海关数据
海关编码
2932190090
海关数据
中国海关编码:
2932190090
概述:
2932190090 其他结构上有非稠合呋喃环化合物. 增值税率:17.0% 退税率:9.0% 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
Summary:
2932190090 other compounds containing an unfused furan ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%
相关文献
1.
Concurrent formation of furan-2,5- and furan-2,4-dicarboxylic acid: unexpected aspects of the Henkel reaction
Shanmugam Thiyagarajan,Aliaksei Pukin,Jacco van Haveren,Martin Lutz,Daan S. van Es RSC Adv. 2013 3 15678
2.
Chemo-enzymatic cascades producing 2,5-furandicarboxylic acid precursors via
d-gluconate “barbell oxidation” and dehydration
Jiao Chen,Jiali Cai,Feng Sha,Wenjun Sun,Xilei Lyu,Yonghui Chang,Fei Cao,Lili Zhao,Hongli Wu,Pingkai Ouyang d-gluconate “barbell oxidation” and dehydration. Jiao Chen Jiali Cai Feng Sha Wenjun Sun Xilei Lyu Yonghui Chang Fei Cao Lili Zhao Hongli Wu Pingkai Ouyang Green Chem. 2023
3.
Endocrine activities of phthalate alternatives; assessing the safety profile of furan dicarboxylic acid esters using a panel of human cell based reporter gene assays
Barbara M. A. van Vugt-Lussenburg,Daan S. van Es,Matthijs Naderman,Jerome le Notre,Frits van der Klis,Abraham Brouwer,Bart van der Burg Green Chem. 2020 22 1873
4.
Evaluating the toxicity of biomass derived platform chemicals
Sónia P. M. Ventura,Paulo de Morais,Jaime A. S. Coelho,Tania Sintra,Jo?o A. P. Coutinho,Carlos A. M. Afonso Green Chem. 2016 18 4733
5.
A scalable carboxylation route to furan-2,5-dicarboxylic acid
Graham R. Dick,Amy D. Frankhouser,Aanindeeta Banerjee,Matthew W. Kanan Green Chem. 2017 19 2966
6.
Conversion of 5-hydroxymethylfurfural to furan-2,5-dicarboxylic acid by a simple and metal-free catalytic system
Xue Wang,Xinyuan Guo,Xinmei Wang,Chi Li,Shanjun Wang,Han Li,Yan’an Gao,Yiying Li,Jinhui Wang,Huanjun Xu RSC Adv. 2023 13 13819
7.
Biobased polyesters and other polymers from 2,5-furandicarboxylic acid: a tribute to furan excellency
Andreia F. Sousa,Carla Vilela,Ana C. Fonseca,Marina Matos,Carmen S. R. Freire,Gert-Jan M. Gruter,Jorge F. J. Coelho,Armando J. D. Silvestre Polym. Chem. 2015 6 5961
8.
Catalytic aerial oxidation of 5-hydroxymethyl-2-furfural to furan-2,5-dicarboxylic acid over Ni–Pd nanoparticles supported on Mg(OH)2 nanoflakes for the synthesis of furan diesters
Kavita Gupta,Rohit K. Rai,Sanjay K. Singh Inorg. Chem. Front. 2017 4 871
9.
Synthesis, characterization and observation of structural diversities in a series of transition metal based furan dicarboxylic acid systems
Rupam Sen,Dasarath Mal,Paula Brand?o,Guillaume Rogez,Zhi Lin CrystEngComm 2013 15 2113
10.
Synthesis of eight isostructural 2D lanthanide coordination polymers assembled by rigid furan-2,5-dicarboxylic acid and flexible adipic acid as linkers and exploration of luminescent Eu/Tb polymers as efficient and sensitive sensors for nitroaromatic compounds
Zaib ul Nisa,Lobzang Tashi,Charanjeet Sen,Nargis Akhter Ashashi,Subash Chandra Sahoo,Haq Nawaz Sheikh New J. Chem. 2020 44 8125
参考资料
Reaxys RN
136780
Beilstein
18(5)7,47
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