Cas no 5638-11-9 (NORCAPERATICACID)
NORCAPERATICACID structure
Product Name:NORCAPERATICACID
CAS No:5638-11-9
MF:C20H36O7
MW:388.49564743042
CID:945292
PubChem ID:12313491
Update Time:2025-04-19
NORCAPERATICACID Chemical and Physical Properties
Names and Identifiers
-
- NORCAPERATICACID
- 2-Hydroxy-heptadecan-1,2,3-tricarbonsaeure
- 2-Oxy-n-heptadecan-tricarbonsaeure-(1.2.3)
- Norcaperatsaeure
- opt. inakt. 2-Hydroxy-heptadecan-1,2,3-tricarbonsaeure
- α-n-Tetradecyl-citronensaeure
- α-Tetradecyl-citronensaeure
- SCHEMBL5929533
- 1,2,3-Heptadecanetricarboxylic acid, 2-hydroxy-
- 5638-11-9
- Norcaperatic acid
- CHEMBL4866141
-
- Inchi： 1S/C20H36O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16(18(23)24)20(27,19(25)26)15-17(21)22/h16,27H,2-15H2,1H3,(H,21,22)(H,23,24)(H,25,26)
- InChI Key： ABKLOAXZFTXYAG-UHFFFAOYSA-N
- SMILES： OC(C(=O)O)(CC(=O)O)C(C(=O)O)CCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 388.24600
- Monoisotopic Mass: 388.24610348g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 27
- Rotatable Bond Count: 18
- Complexity: 450
- 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: 5.4
- Topological Polar Surface Area: 132?2
Experimental Properties
- PSA: 132.13000
- LogP: 4.06880
NORCAPERATICACID Related Literature
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
-
Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
5638-11-9 (NORCAPERATICACID) Related Products
- 5949-29-1(Citric acid monohydrate)
- 6100-05-6(Potassium citrate monohydrate)
- 10402-15-0(Copper Citrate)
- 866-83-1(Potassium Citrate Monobasic)
- 77-92-9(Citric acid)
- 77-95-2(D(-)-Quinic Acid)
- 3012-65-5(Diammonium hydrogen citrate)
- 1123-28-0(1-Hydroxycyclohexanecarboxylic acid)
- 6205-14-7(Hydroxycitric Acid (Technical Grade))
- 7778-49-6(Potassium citrate)
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