Cas no 120699-26-5 (Pentanedioic acid, 2-(2-methylpropyl)-3-oxo-, diethyl ester)
120699-26-5 structure
Product Name:Pentanedioic acid, 2-(2-methylpropyl)-3-oxo-, diethyl ester
CAS No:120699-26-5
MF:C13H22O5
MW:258.310784816742
CID:1211371
PubChem ID:9992659
Update Time:2025-04-20
Pentanedioic acid, 2-(2-methylpropyl)-3-oxo-, diethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Pentanedioic acid, 2-(2-methylpropyl)-3-oxo-, diethyl ester
- diethyl 2-(2-methylpropyl)-3-oxopentanedioate
- SCHEMBL5141925
- AHQCDELDXJJIBH-UHFFFAOYSA-N
- DTXSID20433856
- 120699-26-5
- 2-isobutyl-3-ketoglutarate diethyl ester
-
- Inchi： 1S/C13H22O5/c1-5-17-12(15)8-11(14)10(7-9(3)4)13(16)18-6-2/h9-10H,5-8H2,1-4H3
- InChI Key： AHQCDELDXJJIBH-UHFFFAOYSA-N
- SMILES： O(CC)C(C(C(CC(=O)OCC)=O)CC(C)C)=O
Computed Properties
- Exact Mass: 258.14672380g/mol
- Monoisotopic Mass: 258.14672380g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 10
- Complexity: 296
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.4
- Topological Polar Surface Area: 69.7?2
Pentanedioic acid, 2-(2-methylpropyl)-3-oxo-, diethyl ester Related Literature
-
Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
-
David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
120699-26-5 (Pentanedioic acid, 2-(2-methylpropyl)-3-oxo-, diethyl ester) Related Products
- 517-23-7(2-Acetylbutyrolactone)
- 1540-29-0(Ethyl 2-acetylhexanoate)
- 774-05-0(ethyl 2-oxocycloheptane-1-carboxylate)
- 1655-07-8(ethyl 2-oxocyclohexane-1-carboxylate)
- 607-97-6(Ethyl-2-ethylacetoacetate)
- 1187-74-2(Acetonyl-succinic Acid Diethyl Ester)
- 2163-48-6(Diethyl propylmalonate)
- 570-08-1(Diethyl 2-Acetylmalonate)
- 609-14-3(ethyl 2-methyl-3-oxobutanoate)
- 611-10-9(ethyl 2-oxocyclopentane-1-carboxylate)
Recommended suppliers
Jinan Hanyu Chemical Co.,Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shandong Feiyang Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Hangzhou Cedareal Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Nanjing jingzhu bio-technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
