Cas no 101986-32-7 (3-Oxazolidineacetonitrile, 4-phenyl-, (R)-)
101986-32-7 structure
Product Name:3-Oxazolidineacetonitrile, 4-phenyl-, (R)-
CAS No:101986-32-7
MF:C11H12N2O
MW:188.225782394409
CID:1131426
PubChem ID:11110119
Update Time:2025-04-20
3-Oxazolidineacetonitrile, 4-phenyl-, (R)- Chemical and Physical Properties
Names and Identifiers
-
- 3-Oxazolidineacetonitrile, 4-phenyl-, (R)-
- 101986-32-7
- 3-Oxazolidineacetonitrile, 4-phenyl-, (4R)-
- (R)-2-(4-Phenyloxazolidin-3-yl)acetonitrile
-
- Inchi： 1S/C11H12N2O/c12-6-7-13-9-14-8-11(13)10-4-2-1-3-5-10/h1-5,11H,7-9H2/t11-/m0/s1
- InChI Key： HCCRKULUUAPCGT-NSHDSACASA-N
- SMILES： O1CN(CC#N)[C@H](C2C=CC=CC=2)C1
Computed Properties
- Exact Mass: 188.09506
- Monoisotopic Mass: 188.094963011g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 227
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.3
- Topological Polar Surface Area: 36.3?2
Experimental Properties
- PSA: 36.26
3-Oxazolidineacetonitrile, 4-phenyl-, (R)- Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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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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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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