Cas no 305384-32-1 (1,2-Cyclopentanediol, 3-amino-5-(hydroxymethyl)-, (1S,2S,3R,5R)- (9CI))
305384-32-1 structure
Product Name:1,2-Cyclopentanediol, 3-amino-5-(hydroxymethyl)-, (1S,2S,3R,5R)- (9CI)
CAS No:305384-32-1
MF:C6H13NO3
MW:147.172322034836
CID:299977
PubChem ID:12877397
Update Time:2025-04-19
1,2-Cyclopentanediol, 3-amino-5-(hydroxymethyl)-, (1S,2S,3R,5R)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- 1,2-Cyclopentanediol, 3-amino-5-(hydroxymethyl)-, (1S,2S,3R,5R)- (9CI)
- 1,2-Cyclopentanediol,3-amino-5-(hydroxymethyl)-, (1S,2S,3R,5R)-
- 305384-32-1
- 1,2-Cyclopentanediol,3-amino-5-(hydroxymethyl)-,(1S,2S,3R,5R)-(9ci)
- AKOS006362718
-
- Inchi： 1S/C6H13NO3/c7-4-1-3(2-8)5(9)6(4)10/h3-6,8-10H,1-2,7H2/t3-,4-,5+,6+/m1/s1
- InChI Key： FHNKBDPGQXLKRW-ZXXMMSQZSA-N
- SMILES： O[C@@H]1[C@H]([C@@H](C[C@@H]1CO)N)O
Computed Properties
- Exact Mass: 147.09
- Monoisotopic Mass: 147.09
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 120
- 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
- Topological Polar Surface Area: 86.7A^2
- XLogP3: -1.6
1,2-Cyclopentanediol, 3-amino-5-(hydroxymethyl)-, (1S,2S,3R,5R)- (9CI) Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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