Cas no 153830-19-4 (2-Oxiranecarboxylicacid, 3-methyl-, butyl ester, (2R,3S)-)
153830-19-4 structure
Product Name:2-Oxiranecarboxylicacid, 3-methyl-, butyl ester, (2R,3S)-
CAS No:153830-19-4
MF:C8H14O3
MW:158.194962978363
CID:106355
PubChem ID:2733645
Update Time:2025-04-18
2-Oxiranecarboxylicacid, 3-methyl-, butyl ester, (2R,3S)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Oxiranecarboxylicacid, 3-methyl-, butyl ester, (2R,3S)-
- N-BUTYL (2R,3S)-(-)-2,3-EPOXYBUTYRATE
- 3-Methyl-(2R-trans)-oxiranecarboxylic acid butyl ester
- Butyl 3-methyl-2-(2R,3S)-oxiranecarboxylate
- n-butyl (2R,3S)-epoxybutanoate
- Oxiranecarboxylic acid, 3-methyl-, butyl ester, (2R-trans)- (9CI)
- butyl (3S,2R)-3-methyloxirane-2-carboxylate
- (2R,3S)-butyl 3-methyloxirane-2-carboxylate
- butyl (2R,3S)-3-methyloxirane-2-carboxylate
- 153830-19-4
- N-Butyl(2R,3S)-(-)-2,3-epoxybutyrate
- SCHEMBL9566680
-
- Inchi： 1S/C8H14O3/c1-3-4-5-10-8(9)7-6(2)11-7/h6-7H,3-5H2,1-2H3/t6-,7+/m0/s1
- InChI Key： JMYWLBRCOSLRIH-NKWVEPMBSA-N
- SMILES： O1[C@@H](C(=O)OCCCC)[C@@H]1C
Computed Properties
- Exact Mass: 158.09400
- Monoisotopic Mass: 158.094294304g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 144
- 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
- XLogP3: 1.5
- Topological Polar Surface Area: 38.8?2
Experimental Properties
- PSA: 38.83000
- LogP: 1.11700
2-Oxiranecarboxylicacid, 3-methyl-, butyl ester, (2R,3S)- Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
153830-19-4 (2-Oxiranecarboxylicacid, 3-methyl-, butyl ester, (2R,3S)-) Related Products
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- 691-84-9(Diethyl L-(-)-Malate)
- 83541-68-8((-)-Diisopropyl-L-malate)
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