Cas no 79687-25-5 (Acetic acid, (2-chloro-2-oxoethoxy)-, 2-chloro-2-oxoethyl ester)
79687-25-5 structure
Product Name:Acetic acid, (2-chloro-2-oxoethoxy)-, 2-chloro-2-oxoethyl ester
CAS No:79687-25-5
MF:C6H6Cl2O5
MW:229.014840602875
CID:532427
PubChem ID:12687851
Update Time:2025-04-19
Acetic acid, (2-chloro-2-oxoethoxy)-, 2-chloro-2-oxoethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, (2-chloro-2-oxoethoxy)-, 2-chloro-2-oxoethyl ester
- (2-chloro-2-oxoethyl) 2-(2-chloro-2-oxoethoxy)acetate
- 79687-25-5
- DTXSID40506915
- 2-Chloro-2-oxoethyl (2-chloro-2-oxoethoxy)acetate
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- Inchi： 1S/C6H6Cl2O5/c7-4(9)1-12-3-6(11)13-2-5(8)10/h1-3H2
- InChI Key： YLENGZFMSHISLS-UHFFFAOYSA-N
- SMILES： ClC(COCC(=O)OCC(=O)Cl)=O
Computed Properties
- Exact Mass: 227.9592287g/mol
- Monoisotopic Mass: 227.9592287g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 13
- Rotatable Bond Count: 7
- Complexity: 215
- 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: 1.2
- Topological Polar Surface Area: 69.7?2
Acetic acid, (2-chloro-2-oxoethoxy)-, 2-chloro-2-oxoethyl ester Related Literature
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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