Cas no 70543-40-7 (Isopentyl 5-chloropentanoate)
Isopentyl 5-chloropentanoate structure
Product Name:Isopentyl 5-chloropentanoate
CAS No:70543-40-7
MF:C10H19ClO2
MW:206.709662675858
CID:975302
PubChem ID:550816
Update Time:2025-04-19
Isopentyl 5-chloropentanoate Chemical and Physical Properties
Names and Identifiers
-
- Isopentyl 5-chloropentanoate
- 3-methylbutyl 5-chloropentanoate
- JOEKXOJRCYDLJL-UHFFFAOYSA-N
- DTXSID10338725
- Isopentyl 5-chloropentanoate #
- 70543-40-7
- 5-Chloropentanoic acid, 3-methylbutyl ester
-
- Inchi： 1S/C10H19ClO2/c1-9(2)6-8-13-10(12)5-3-4-7-11/h9H,3-8H2,1-2H3
- InChI Key： JOEKXOJRCYDLJL-UHFFFAOYSA-N
- SMILES： ClCCCCC(=O)OCCC(C)C
Computed Properties
- Exact Mass: 206.1073575g/mol
- Monoisotopic Mass: 206.1073575g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 8
- Complexity: 135
- 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: 3
- Topological Polar Surface Area: 26.3?2
Isopentyl 5-chloropentanoate Related Literature
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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