Cas no 15896-08-9 (1,3-Dioxolan-2-one, 4,5-diethyl-)
15896-08-9 structure
Product Name:1,3-Dioxolan-2-one, 4,5-diethyl-
CAS No:15896-08-9
MF:C7H12O3
MW:144.168382644653
CID:2779954
PubChem ID:10130023
Update Time:2025-04-21
1,3-Dioxolan-2-one, 4,5-diethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Dioxolan-2-one, 4,5-diethyl-
- DTXSID20435936
- 15896-08-9
- DTXCID70386762
- SCHEMBL1070559
-
- Inchi： 1S/C7H12O3/c1-3-5-6(4-2)10-7(8)9-5/h5-6H,3-4H2,1-2H3
- InChI Key： UAUBPLHWJOYCHE-UHFFFAOYSA-N
- SMILES： O1C(=O)OC(CC)C1CC
Computed Properties
- Exact Mass: 144.078644241Da
- Monoisotopic Mass: 144.078644241Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 119
- 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: 2.2
- Topological Polar Surface Area: 35.5?2
1,3-Dioxolan-2-one, 4,5-diethyl- Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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