Cas no 762229-97-0 (2(3H)-Furanone,3-amino-5-butyldihydro-, (3R,5S)-)
762229-97-0 structure
Product Name:2(3H)-Furanone,3-amino-5-butyldihydro-, (3R,5S)-
CAS No:762229-97-0
MF:C8H15NO2
MW:157.210202455521
CID:550182
PubChem ID:45082208
Update Time:2025-04-19
2(3H)-Furanone,3-amino-5-butyldihydro-, (3R,5S)- Chemical and Physical Properties
Names and Identifiers
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- 2(3H)-Furanone,3-amino-5-butyldihydro-, (3R,5S)-
- 2(3H)-Furanone, 3-amino-5-butyldihydro-, (3R,5S)- (9CI)
- (3R,5S)-3-amino-5-butyloxolan-2-one
- DTXSID30665181
- 762229-97-0
-
- Inchi： 1S/C8H15NO2/c1-2-3-4-6-5-7(9)8(10)11-6/h6-7H,2-5,9H2,1H3/t6-,7+/m0/s1
- InChI Key： OLYWNFJDCDKNSI-NKWVEPMBSA-N
- SMILES： O1C([C@@H](C[C@@H]1CCCC)N)=O
Computed Properties
- Exact Mass: 157.11
- Monoisotopic Mass: 157.11
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 147
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 52.3A^2
- Surface Charge: 0
- Tautomer Count: 4
- XLogP3: 1.2
2(3H)-Furanone,3-amino-5-butyldihydro-, (3R,5S)- Related Literature
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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