Cas no 783297-96-1 (Cyclopentanecarboxylicacid, 4-amino-2,3-bis(hydroxymethyl)-, (1R,2S,3S,4S)-rel-)
783297-96-1 structure
Product Name:Cyclopentanecarboxylicacid, 4-amino-2,3-bis(hydroxymethyl)-, (1R,2S,3S,4S)-rel-
CAS No:783297-96-1
MF:C8H15NO4
MW:189.209002733231
CID:554101
PubChem ID:45089193
Update Time:2025-04-19
Cyclopentanecarboxylicacid, 4-amino-2,3-bis(hydroxymethyl)-, (1R,2S,3S,4S)-rel- Chemical and Physical Properties
Names and Identifiers
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- Cyclopentanecarboxylicacid, 4-amino-2,3-bis(hydroxymethyl)-, (1R,2S,3S,4S)-rel-
- Cyclopentanecarboxylic acid, 4-amino-2,3-bis(hydroxymethyl)-, (1R,2S,3S,4S)-
- Cyclopentanecarboxylic acid,4-amino-2,3-bis(hydroxymethyl)-,(1R,2S,3S,4S)-
- 783297-96-1
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- Inchi： 1S/C8H15NO4/c9-7-1-4(8(12)13)5(2-10)6(7)3-11/h4-7,10-11H,1-3,9H2,(H,12,13)/t4-,5-,6+,7+/m1/s1
- InChI Key： AINPXDXTASBUPL-JWXFUTCRSA-N
- SMILES： OC[C@@H]1[C@H](C(=O)O)C[C@@H]([C@H]1CO)N
Computed Properties
- Exact Mass: 189.10000
- Monoisotopic Mass: 189.10010796g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 197
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -3.6
- Topological Polar Surface Area: 104?2
Experimental Properties
- PSA: 103.78000
- LogP: -0.66450
Cyclopentanecarboxylicacid, 4-amino-2,3-bis(hydroxymethyl)-, (1R,2S,3S,4S)-rel- Related Literature
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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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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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
783297-96-1 (Cyclopentanecarboxylicacid, 4-amino-2,3-bis(hydroxymethyl)-, (1R,2S,3S,4S)-rel-) Related Products
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