Cas no 752190-79-7 (Butanoic acid-13C4)
Butanoic acid-13C4 structure
Product Name:Butanoic acid-13C4
CAS No:752190-79-7
MF:C4H8O2
MW:92.075740814209
CID:2801090
PubChem ID:16213394
Update Time:2024-03-01
Butanoic acid-13C4 Chemical and Physical Properties
Names and Identifiers
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- Butanoic acid-13C4
- Butyric acid-13C4
- BUTYRIC ACID (13C4, 99%)
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- Inchi： 1S/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6)/i1+1,2+1,3+1,4+1
- InChI Key： FERIUCNNQQJTOY-JCDJMFQYSA-N
- SMILES： [13C](O)(=O)[13CH2][13CH2][13CH3]
Computed Properties
- Exact Mass: 92.06584884g/mol
- Monoisotopic Mass: 92.06584884g/mol
- Isotope Atom Count: 4
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 6
- Rotatable Bond Count: 2
- Complexity: 49.5
- 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: 37.3?2
Butanoic acid-13C4 Related Literature
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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