Cas no 53657-15-1 (2(3H)-Furanone, dihydro-4-(1-methylethyl)-, (S)-)
53657-15-1 structure
Product Name:2(3H)-Furanone, dihydro-4-(1-methylethyl)-, (S)-
CAS No:53657-15-1
MF:C7H12O2
MW:128.168982505798
CID:356749
PubChem ID:11083905
Update Time:2025-04-19
2(3H)-Furanone, dihydro-4-(1-methylethyl)-, (S)- Chemical and Physical Properties
Names and Identifiers
-
- 2(3H)-Furanone, dihydro-4-(1-methylethyl)-, (S)-
- (4S)-4-propan-2-yloxolan-2-one
- (S)-4-Isopropyldihydrofuran-2(3H)-one
- 53657-15-1
- SCHEMBL3123302
- DTXSID40454523
- (S)-beta-(2-propyl)-gamma-butyrolactone
- KSHNENOHFJQWJE-ZCFIWIBFSA-N
-
- Inchi： 1S/C7H12O2/c1-5(2)6-3-7(8)9-4-6/h5-6H,3-4H2,1-2H3/t6-/m1/s1
- InChI Key： KSHNENOHFJQWJE-ZCFIWIBFSA-N
- SMILES： O1C(C[C@H](C1)C(C)C)=O
Computed Properties
- Exact Mass: 128.08376
- Monoisotopic Mass: 128.083729621g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 118
- 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: 1.4
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
2(3H)-Furanone, dihydro-4-(1-methylethyl)-, (S)- Related Literature
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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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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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
53657-15-1 (2(3H)-Furanone, dihydro-4-(1-methylethyl)-, (S)-) Related Products
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