Cas no 19614-29-0 (aziridin-1-yl(4-nitrophenyl)methanone)
19614-29-0 structure
Product Name:aziridin-1-yl(4-nitrophenyl)methanone
aziridin-1-yl(4-nitrophenyl)methanone Chemical and Physical Properties
Names and Identifiers
-
- aziridin-1-yl(4-nitrophenyl)methanone
- Aziridine, 1- (4-nitrobenzoyl)-
- Aziridine, 1- (p-nitrobenzoyl)-
- 1-(p-Nitrobenzoyl)aziridine
- aziridin-1-yl-(4-nitrophenyl)methanone
- NSC 50704
- NSC-50704
- NSC50704
- 1-(4-Nitrobenzoyl)aziridine
- BRN 0168173
- Y72XXE9V6P
- DTXSID30173276
- N-(p-Nitrobenzoyl)aziridine
- 1-Aziridinyl(4-nitrophenyl)methanone
- 5-20-01-00040 (Beilstein Handbook Reference)
- UNII-Y72XXE9V6P
- Methanone, 1-aziridinyl(4-nitrophenyl)-
- Aziridine, 1-(4-nitrobenzoyl)-
- 19614-29-0
- p-Nitrobenzoylethyleneimine
- SCHEMBL9152022
- AI3-50751
- AZIRIDINE, 1-(p-NITROBENZOYL)-
-
- Inchi： 1S/C9H8N2O3/c12-9(10-5-6-10)7-1-3-8(4-2-7)11(13)14/h1-4H,5-6H2
- InChI Key： WUTHXPCLBWBKMP-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC(=CC=1)[N+](=O)[O-])N1CC1
Computed Properties
- Exact Mass: 192.05354
- Monoisotopic Mass: 192.05349212g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 249
- 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: 1.6
- Topological Polar Surface Area: 65.9?2
Experimental Properties
- PSA: 63.22
aziridin-1-yl(4-nitrophenyl)methanone Related Literature
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
-
Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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