Cas no 94857-80-4 (Aziridine, 1-(4-hydroxybenzoyl)- (9CI))
94857-80-4 structure
Product Name:Aziridine, 1-(4-hydroxybenzoyl)- (9CI)
CAS No:94857-80-4
MF:C9H9NO2
MW:163.173262357712
CID:1022350
PubChem ID:45084015
Update Time:2025-04-20
Aziridine, 1-(4-hydroxybenzoyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Aziridine, 1-(4-hydroxybenzoyl)- (9CI)
- aziridin-1-yl-(4-hydroxyphenyl)methanone
- Aziridin-1-yl(4-hydroxyphenyl)methanone
- N-(p-hydroxybenzoyl)ethylenimine
- 4-(AZIRIDINE-1-CARBONYL)PHENOL
- SCHEMBL14523155
- (Aziridin-1-yl)(4-hydroxyphenyl)methanone
- Aziridine,1-(4-hydroxybenzoyl)-(9ci)
- DTXSID50665527
- 94857-80-4
- DB-273496
- AZIRIDINE, 1-(4-HYDROXYBENZOYL)-
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- Inchi： 1S/C9H9NO2/c11-8-3-1-7(2-4-8)9(12)10-5-6-10/h1-4,11H,5-6H2
- InChI Key： ZUJWMOYNGYFHIA-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC(=CC=1)O)N1CC1
Computed Properties
- Exact Mass: 163.063328530g/mol
- Monoisotopic Mass: 163.063328530g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 181
- 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: 0.8
- Topological Polar Surface Area: 40.3?2
Aziridine, 1-(4-hydroxybenzoyl)- (9CI) Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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