Cas no 28115-45-9 (2-Pyrrolidinemethanol,1-acetyl-5-methyl-, cis- (8CI))
28115-45-9 structure
Product Name:2-Pyrrolidinemethanol,1-acetyl-5-methyl-, cis- (8CI)
CAS No:28115-45-9
MF:C8H15NO2
MW:157.210202455521
CID:251779
PubChem ID:45086106
Update Time:2025-04-19
2-Pyrrolidinemethanol,1-acetyl-5-methyl-, cis- (8CI) Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyrrolidinemethanol,1-acetyl-5-methyl-, cis- (8CI)
- 28115-45-9
- 1-((2S,5S)-2-(Hydroxymethyl)-5-methylpyrrolidin-1-yl)ethanone
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- Inchi： 1S/C8H15NO2/c1-6-3-4-8(5-10)9(6)7(2)11/h6,8,10H,3-5H2,1-2H3/t6-,8-/m0/s1
- InChI Key： XXIAQHKXMUPUHO-XPUUQOCRSA-N
- SMILES： OC[C@@H]1CC[C@H](C)N1C(C)=O
Computed Properties
- Exact Mass: 157.11
- Monoisotopic Mass: 157.11
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 158
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 40.5A^2
- XLogP3: 0
2-Pyrrolidinemethanol,1-acetyl-5-methyl-, cis- (8CI) Related Literature
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1. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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