Cas no 270260-38-3 (Benzaldehyde,4-(1-hydroxyethyl)-, oxime)
270260-38-3 structure
Product Name:Benzaldehyde,4-(1-hydroxyethyl)-, oxime
CAS No:270260-38-3
MF:C9H11NO2
MW:165.189142465591
CID:247981
PubChem ID:57376513
Update Time:2025-04-19
Benzaldehyde,4-(1-hydroxyethyl)-, oxime Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde,4-(1-hydroxyethyl)-, oxime
- 4-Benzylbenzaldehydeoxime
- 1-[4-(hydroxyiminomethyl)phenyl]ethanol
- DTXSID10725212
- Benzaldehyde,4-(1-hydroxyethyl)-,oxime(9ci)
- 270260-38-3
- 1-{4-[(Hydroxyimino)methyl]phenyl}ethan-1-ol
-
- Inchi： 1S/C9H11NO2/c1-7(11)9-4-2-8(3-5-9)6-10-12/h2-7,11-12H,1H3
- InChI Key： FQVRFXRMZTVRKK-UHFFFAOYSA-N
- SMILES： OC(C)C1C=CC(C=NO)=CC=1
Computed Properties
- Exact Mass: 165.07903
- Monoisotopic Mass: 165.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 151
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 1.6
- Topological Polar Surface Area: 52.8?2
Experimental Properties
- PSA: 52.82
Benzaldehyde,4-(1-hydroxyethyl)-, oxime Related Literature
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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