Cas no 63296-56-0 (Propanal, 2-[(phenylmethoxy)methoxy]-, (2S)-)
63296-56-0 structure
Product Name:Propanal, 2-[(phenylmethoxy)methoxy]-, (2S)-
CAS No:63296-56-0
MF:C11H14O3
MW:194.227063655853
CID:426848
PubChem ID:10997886
Update Time:2025-04-19
Propanal, 2-[(phenylmethoxy)methoxy]-, (2S)- Chemical and Physical Properties
Names and Identifiers
-
- Propanal, 2-[(phenylmethoxy)methoxy]-, (2S)-
- 63296-56-0
- DTXSID80451253
-
- Inchi: 1S/C11H14O3/c1-10(7-12)14-9-13-8-11-5-3-2-4-6-11/h2-7,10H,8-9H2,1H3/t10-/m0/s1
- InChI Key: HOLIWIAOUNQYRC-JTQLQIEISA-N
- SMILES: O(CO[C@H](C=O)C)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 194.09432
- Monoisotopic Mass: 194.094294304g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 6
- Complexity: 153
- 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: 1.5
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
Propanal, 2-[(phenylmethoxy)methoxy]-, (2S)- Related Literature
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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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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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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