Cas no 944663-75-6 (2-(4-(3-Nitrophenyl)piperazin-1-yl)ethanol)
944663-75-6 structure
Product Name:2-(4-(3-Nitrophenyl)piperazin-1-yl)ethanol
CAS No:944663-75-6
MF:C12H17N3O3
MW:251.281682729721
CID:1094703
PubChem ID:4742580
Update Time:2025-04-20
2-(4-(3-Nitrophenyl)piperazin-1-yl)ethanol Chemical and Physical Properties
Names and Identifiers
-
- 2-(4-(3-Nitrophenyl)piperazin-1-yl)ethanol
- 2-[4-(3-nitrophenyl)piperazin-1-yl]ethanol
- AKOS003588745
- 944663-75-6
- YCNGAGLFFCNTRT-UHFFFAOYSA-N
- 2-[4-(3-nitrophenyl)-piperazin-1-yl]-ethanol
- SCHEMBL520396
-
- Inchi： 1S/C12H17N3O3/c16-9-8-13-4-6-14(7-5-13)11-2-1-3-12(10-11)15(17)18/h1-3,10,16H,4-9H2
- InChI Key： YCNGAGLFFCNTRT-UHFFFAOYSA-N
- SMILES： OCCN1CCN(C2C=CC=C(C=2)[N+](=O)[O-])CC1
Computed Properties
- Exact Mass: 251.12699141g/mol
- Monoisotopic Mass: 251.12699141g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 274
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1
- Topological Polar Surface Area: 72.5?2
2-(4-(3-Nitrophenyl)piperazin-1-yl)ethanol Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
944663-75-6 (2-(4-(3-Nitrophenyl)piperazin-1-yl)ethanol) Related Products
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