Cas no 139058-87-0 (1,3-Benzodioxole-5-carboxylic acid,4-(2-carboxy-4,5-dimethoxyphenyl)-)
139058-87-0 structure
Product Name:1,3-Benzodioxole-5-carboxylic acid,4-(2-carboxy-4,5-dimethoxyphenyl)-
CAS No:139058-87-0
MF:C17H14O8
MW:346.288265705109
CID:1269550
Update Time:2024-08-04
1,3-Benzodioxole-5-carboxylic acid,4-(2-carboxy-4,5-dimethoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
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- 1,3-Benzodioxole-5-carboxylic acid,4-(2-carboxy-4,5-dimethoxyphenyl)-
- 1,3-Benzodioxole-5-carboxylic acid, 4-(2-carboxy-4,5-dimethoxyphenyl)-
-
- Inchi： 1S/C17H14O8/c1-22-12-5-9(10(17(20)21)6-13(12)23-2)14-8(16(18)19)3-4-11-15(14)25-7-24-11/h3-6H,7H2,1-2H3,(H,18,19)(H,20,21)
- InChI Key： ZVWVPHICDLAPQZ-UHFFFAOYSA-N
- SMILES： O1C2=CC=C(C(O)=O)C(C3=CC(OC)=C(OC)C=C3C(O)=O)=C2OC1
Computed Properties
- Exact Mass: 346.06882
Experimental Properties
- Density: 1.449±0.06 g/cm3(Predicted)
- Boiling Point: 506.1±50.0 °C(Predicted)
- PSA: 111.52
- pka: 3.90±0.20(Predicted)
1,3-Benzodioxole-5-carboxylic acid,4-(2-carboxy-4,5-dimethoxyphenyl)- Related Literature
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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