Cas no 10428-69-0 (4,4-Bis(2-carboxyethyl)heptanedioic acid)
10428-69-0 structure
Product Name:4,4-Bis(2-carboxyethyl)heptanedioic acid
CAS No:10428-69-0
MF:C13H20O8
MW:304.293105125427
CID:2623658
PubChem ID:14950128
Update Time:2025-04-21
4,4-Bis(2-carboxyethyl)heptanedioic acid Chemical and Physical Properties
Names and Identifiers
-
- 4,4-BIS(2-CARBOXYETHYL)HEPTANEDIOIC ACID
- 10428-69-0
- DTXCID40516716
- DTXSID80565940
- SCHEMBL14963643
- 4,4-Bis(2-carboxyethyl)heptanedioic acid
-
- Inchi： 1S/C13H20O8/c14-9(15)1-5-13(6-2-10(16)17,7-3-11(18)19)8-4-12(20)21/h1-8H2,(H,14,15)(H,16,17)(H,18,19)(H,20,21)
- InChI Key： IPKZFEOIDJTBKJ-UHFFFAOYSA-N
- SMILES： OC(CCC(CCC(=O)O)(CCC(=O)O)CCC(=O)O)=O
Computed Properties
- Exact Mass: 304.11581759Da
- Monoisotopic Mass: 304.11581759Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 21
- Rotatable Bond Count: 12
- Complexity: 323
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.2
- Topological Polar Surface Area: 149?2
4,4-Bis(2-carboxyethyl)heptanedioic acid Related Literature
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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5. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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