Cas no 821801-01-8 (Butanamide, N-[(1S)-2-oxocycloheptyl]-)
![Butanamide, N-[(1S)-2-oxocycloheptyl]- structure](https://ossimg.kuujia.com/scimg/822000/821801-01-8x500.png)
821801-01-8 structure
Product Name:Butanamide, N-[(1S)-2-oxocycloheptyl]-
CAS No:821801-01-8
MF:C11H19NO2
MW:197.27406334877
CID:696225
PubChem ID:11298545
Update Time:2025-04-19
Butanamide, N-[(1S)-2-oxocycloheptyl]- Chemical and Physical Properties
Names and Identifiers
-
- Butanamide, N-[(1S)-2-oxocycloheptyl]-
- N-[(1S)-2-oxocycloheptyl]butanamide
- 821801-01-8
- DTXSID50461586
-
- Inchi： 1S/C11H19NO2/c1-2-6-11(14)12-9-7-4-3-5-8-10(9)13/h9H,2-8H2,1H3,(H,12,14)/t9-/m0/s1
- InChI Key： SCWVGSOLKATSDY-VIFPVBQESA-N
- SMILES： O=C1CCCCC[C@@H]1NC(CCC)=O
Computed Properties
- Exact Mass: 197.141578849g/mol
- Monoisotopic Mass: 197.141578849g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 213
- 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: 1.6
- Topological Polar Surface Area: 46.2?2
Butanamide, N-[(1S)-2-oxocycloheptyl]- Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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