Cas no 74742-36-2 (Tricyclo[5.2.0.0(2,5)]nonane-3,4,8,9-tetracarboxylic acid, 6-oxo-, tetramethyl ester)
74742-36-2 structure
Product Name:Tricyclo[5.2.0.0(2,5)]nonane-3,4,8,9-tetracarboxylic acid, 6-oxo-, tetramethyl ester
CAS No:74742-36-2
MF:C17H20O9
MW:368.335306167603
CID:2673569
Update Time:2023-08-06
Tricyclo[5.2.0.0(2,5)]nonane-3,4,8,9-tetracarboxylic acid, 6-oxo-, tetramethyl ester Chemical and Physical Properties
Names and Identifiers
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- 6-Oxotricyclo[5.2.0.02,5]nonane-3,4,8,9-tetracarboxylic acid tetramethyl ester
- Tricyclo[5.2.0.0(2,5)]nonane-3,4,8,9-tetracarboxylic acid, 6-oxo-, tetramethyl ester
- GQYLJCMXRRDBPR-UHFFFAOYSA-N
-
- Inchi: 1S/C17H20O9/c1-23-14(19)9-5-6-8(13(18)7(5)11(9)16(21)25-3)12(17(22)26-4)10(6)15(20)24-2/h5-12H,1-4H3
- InChI Key: GQYLJCMXRRDBPR-UHFFFAOYSA-N
- SMILES: O=C1C2C(C(=O)OC)C(C(=O)OC)C2C2C(C(=O)OC)C(C(=O)OC)C21
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 26
- Rotatable Bond Count: 8
- Complexity: 628
- Topological Polar Surface Area: 122
Tricyclo[5.2.0.0(2,5)]nonane-3,4,8,9-tetracarboxylic acid, 6-oxo-, tetramethyl ester Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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