Cas no 62821-17-4 (Bicyclo[3.2.1]octane-8,8-dicarboxylic acid)
62821-17-4 structure
Product Name:Bicyclo[3.2.1]octane-8,8-dicarboxylic acid
CAS No:62821-17-4
MF:C10H14O4
MW:198.215763568878
CID:430445
PubChem ID:71382468
Update Time:2025-04-19
Bicyclo[3.2.1]octane-8,8-dicarboxylic acid Chemical and Physical Properties
Names and Identifiers
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- Bicyclo[3.2.1]octane-8,8-dicarboxylic acid
- 62821-17-4
- DTXSID80804846
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- Inchi: 1S/C10H14O4/c11-8(12)10(9(13)14)6-2-1-3-7(10)5-4-6/h6-7H,1-5H2,(H,11,12)(H,13,14)
- InChI Key: WLYHBXXHTQLIBT-UHFFFAOYSA-N
- SMILES: OC(C1(C(=O)O)C2CCCC1CC2)=O
Computed Properties
- Exact Mass: 198.08922
- Monoisotopic Mass: 198.08920892g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 256
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.1
- Topological Polar Surface Area: 74.6?2
Experimental Properties
- PSA: 74.6
Bicyclo[3.2.1]octane-8,8-dicarboxylic acid Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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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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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
62821-17-4 (Bicyclo[3.2.1]octane-8,8-dicarboxylic acid) Related Products
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