Cas no 3058-09-1 (2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-dicarboxylicacid, 3,9-dimethyl ester)
3058-09-1 structure
Product Name:2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-dicarboxylicacid, 3,9-dimethyl ester
CAS No:3058-09-1
MF:C11H16O8
MW:276.239944458008
CID:309490
PubChem ID:240833
Update Time:2025-04-19
2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-dicarboxylicacid, 3,9-dimethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-dicarboxylicacid, 3,9-dimethyl ester
- 2,4,8,10-Tetraoxa-spiro[5.5]undecan-3,9-dicarbonsaeure-dimethylester
- 2,4,8,10-tetraoxa-spiro[5.5]undecane-3,9-dicarboxylic acid dimethyl ester
- AC1L6624
- AC1Q5ZM4
- AG-F-00883
- AR-1I5447
- CTK4G5451
- NSC47618
- SureCN9679297
- NSC-47618
- 3058-09-1
- dimethyl 2,4,8,10-tetraoxaspiro[5.5]undecane-3,9-dicarboxylate
- SCHEMBL9679297
- DTXSID20286788
-
- Inchi: 1S/C11H16O8/c1-14-7(12)9-16-3-11(4-17-9)5-18-10(19-6-11)8(13)15-2/h9-10H,3-6H2,1-2H3
- InChI Key: KVTIIRWSQVXMGO-UHFFFAOYSA-N
- SMILES: O1C(C(=O)OC)OCC2(COC(C(=O)OC)OC2)C1
Computed Properties
- Exact Mass: 276.08448
- Monoisotopic Mass: 276.08451746g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 301
- 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: -0.6
- Topological Polar Surface Area: 89.5?2
Experimental Properties
- PSA: 89.52
- LogP: -0.93540
2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-dicarboxylicacid, 3,9-dimethyl ester Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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