Cas no 192045-61-7 (1-Propanol, 2-nitro-, (S)-)
1-Propanol, 2-nitro-, (S)- structure
Product Name:1-Propanol, 2-nitro-, (S)-
CAS No:192045-61-7
MF:C3H7NO3
MW:105.092581033707
CID:2787407
Update Time:2023-08-07
1-Propanol, 2-nitro-, (S)- Chemical and Physical Properties
Names and Identifiers
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- 1-Propanol, 2-nitro-, (S)-
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- Inchi： 1S/C3H7NO3/c1-3(2-5)4(6)7/h3,5H,2H2,1H3/t3-/m0/s1
- InChI Key： PCNWBUOSTLGPMI-VKHMYHEASA-N
- SMILES： OC[C@H](C)[N+](=O)[O-]
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 7
- Rotatable Bond Count: 1
- Complexity: 67.1
- XLogP3: -0.3
- Topological Polar Surface Area: 66
1-Propanol, 2-nitro-, (S)- Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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