Cas no 5018-35-9 (Propanedioic acid, propoxy-, dimethyl ester)
5018-35-9 structure
Product Name:Propanedioic acid, propoxy-, dimethyl ester
CAS No:5018-35-9
MF:C8H14O5
MW:190.193763256073
CID:365573
PubChem ID:71366740
Update Time:2025-04-19
Propanedioic acid, propoxy-, dimethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanedioic acid, propoxy-, dimethyl ester
- dimethyl 2-propoxypropanedioate
- Dimethyl propoxypropanedioate
- DTXSID20790092
- 5018-35-9
-
- Inchi： 1S/C8H14O5/c1-4-5-13-6(7(9)11-2)8(10)12-3/h6H,4-5H2,1-3H3
- InChI Key： XBIALNHVSMBJFX-UHFFFAOYSA-N
- SMILES： O(C(C(=O)OC)C(=O)OC)CCC
Computed Properties
- Exact Mass: 190.08412
- Monoisotopic Mass: 190.08412354g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 13
- Rotatable Bond Count: 7
- Complexity: 161
- 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: 1
- Topological Polar Surface Area: 61.8?2
Experimental Properties
- PSA: 61.83
Propanedioic acid, propoxy-, dimethyl ester Related Literature
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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