Cas no 62821-26-5 (Bicyclo[2.2.1]heptane-2,2-dicarboxylic acid)
62821-26-5 structure
Product Name:Bicyclo[2.2.1]heptane-2,2-dicarboxylic acid
CAS No:62821-26-5
MF:C9H12O4
MW:184.189183235168
CID:430436
PubChem ID:14226066
Update Time:2025-04-19
Bicyclo[2.2.1]heptane-2,2-dicarboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- Bicyclo[2.2.1]heptane-2,2-dicarboxylic acid
- bicyclo[2.2.1]heptane-3,3-dicarboxylic acid
- 62821-26-5
- DTXSID70557677
- SCHEMBL2761577
-
- Inchi: 1S/C9H12O4/c10-7(11)9(8(12)13)4-5-1-2-6(9)3-5/h5-6H,1-4H2,(H,10,11)(H,12,13)
- InChI Key: BWWABJCTNYPMGD-UHFFFAOYSA-N
- SMILES: OC(C1(C(=O)O)CC2CCC1C2)=O
Computed Properties
- Exact Mass: 184.07356
- Monoisotopic Mass: 184.07355886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 257
- 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: 1.4
- Topological Polar Surface Area: 74.6?2
Experimental Properties
- PSA: 74.6
Bicyclo[2.2.1]heptane-2,2-dicarboxylic acid Related Literature
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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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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
62821-26-5 (Bicyclo[2.2.1]heptane-2,2-dicarboxylic acid) Related Products
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