Cas no 1160-32-3 (dibutyl 2,5-dioxocyclohexane-1,4-dicarboxylate)
1160-32-3 structure
Product Name:dibutyl 2,5-dioxocyclohexane-1,4-dicarboxylate
CAS No:1160-32-3
MF:C16H24O6
MW:312.358165740967
CID:2613954
PubChem ID:11034308
Update Time:2025-04-21
dibutyl 2,5-dioxocyclohexane-1,4-dicarboxylate Chemical and Physical Properties
Names and Identifiers
-
- dibutyl 2,5-dioxocyclohexane-1,4-dicarboxylate
- 1160-32-3
- DTXSID50452777
- 1,4-Cyclohexanedicarboxylic acid, 2,5-dioxo-, dibutyl ester
- SCHEMBL7823966
-
- Inchi： 1S/C16H24O6/c1-3-5-7-21-15(19)11-9-14(18)12(10-13(11)17)16(20)22-8-6-4-2/h11-12H,3-10H2,1-2H3
- InChI Key： QWJQTDZOQNQJDW-UHFFFAOYSA-N
- SMILES： O(CCCC)C(C1C(CC(C(=O)OCCCC)C(C1)=O)=O)=O
Computed Properties
- Exact Mass: 312.15728848Da
- Monoisotopic Mass: 312.15728848Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 22
- Rotatable Bond Count: 10
- Complexity: 388
- 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: 2.1
- Topological Polar Surface Area: 86.7?2
dibutyl 2,5-dioxocyclohexane-1,4-dicarboxylate Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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