Cas no 1632-97-9 (Acetaldehyde-14C2(7CI,8CI,9CI))
1632-97-9 structure
Product Name:Acetaldehyde-14C2(7CI,8CI,9CI)
Acetaldehyde-14C2(7CI,8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- Acetaldehyde-14C2(7CI,8CI,9CI)
- ACETALDEHYDE, [1,2-14C]
- [1,2]diazepine-1-carboxylic acid methyl ester
- [1,2-14C]acetaldehyde
- 1H-1,2-DIAZEPINE-1-CARBOXYLIC ACID METHYL ESTER
- 1H-1,2-Diazepine-1-carboxylicacid,methylester(9CI)
- ACMC-20mvqk
- AG-D-72332
- CTK4B9785
- SureCN4256331
- DTXSID401316448
- 1632-97-9
- Acetaldehyde-14C2
- Acetaldehyde,[1,2-14c]
-
- Inchi： 1S/C2H4O/c1-2-3/h2H,1H3/i1+2,2+2
- InChI Key： IKHGUXGNUITLKF-XPULMUKRSA-N
- SMILES： O=[14CH][14CH3]
Computed Properties
- Exact Mass: 48.033
- Monoisotopic Mass: 48.033
- Isotope Atom Count: 2
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 3
- Rotatable Bond Count: 0
- Complexity: 10.3
- 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
- Topological Polar Surface Area: 17.1A^2
- XLogP3: -0.3
Experimental Properties
- Density: 0.813
- Boiling Point: 23.5 °C at 760 mmHg
- PSA: 17.07000
- LogP: 0.20520
Acetaldehyde-14C2(7CI,8CI,9CI) Related Literature
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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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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