Cas no 86296-18-6 (Cyclopentanecarboxylic acid, 2-acetyl-5-oxo-, methyl ester)
86296-18-6 structure
Product Name:Cyclopentanecarboxylic acid, 2-acetyl-5-oxo-, methyl ester
CAS No:86296-18-6
MF:C9H12O4
MW:184.189183235168
CID:662091
PubChem ID:13213561
Update Time:2025-04-19
Cyclopentanecarboxylic acid, 2-acetyl-5-oxo-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Cyclopentanecarboxylic acid, 2-acetyl-5-oxo-, methyl ester
- methyl 2-acetyl-5-oxocyclopentane-1-carboxylate
- 86296-18-6
- SCHEMBL7199227
- 2-methoxycarbonyl-3-acetyl-cyclopentanone
- BFLLIBBCGVMZMN-UHFFFAOYSA-N
- DTXSID90528506
-
- Inchi： 1S/C9H12O4/c1-5(10)6-3-4-7(11)8(6)9(12)13-2/h6,8H,3-4H2,1-2H3
- InChI Key： BFLLIBBCGVMZMN-UHFFFAOYSA-N
- SMILES： O=C1CCC(C(C)=O)C1C(=O)OC
Computed Properties
- Exact Mass: 184.07355886g/mol
- Monoisotopic Mass: 184.07355886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 256
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.2
- Topological Polar Surface Area: 60.4?2
Cyclopentanecarboxylic acid, 2-acetyl-5-oxo-, methyl ester Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
86296-18-6 (Cyclopentanecarboxylic acid, 2-acetyl-5-oxo-, methyl ester) Related Products
- 1540-29-0(Ethyl 2-acetylhexanoate)
- 24851-98-7(Methyl dihydrojasmonate)
- 10420-33-4(1,4-dimethyl 2-acetylbutanedioate)
- 774-05-0(ethyl 2-oxocycloheptane-1-carboxylate)
- 607-97-6(Ethyl-2-ethylacetoacetate)
- 24922-00-7(Ethyl 3-cyclopentyl-3-oxopropanoate)
- 32249-35-7(Methyl 3-cyclopropyl-3-oxopropanoate)
- 10472-24-9(methyl 2-oxocyclopentane-1-carboxylate)
- 42558-54-3(Methyl 4-methyl-3-oxopentanoate)
- 611-10-9(ethyl 2-oxocyclopentane-1-carboxylate)
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