Cas no 131801-45-1 (1-Chloroethyl oxan-4-yl carbonate)
131801-45-1 structure
Product Name:1-Chloroethyl oxan-4-yl carbonate
CAS No:131801-45-1
MF:C8H13ClO4
MW:208.639422178268
CID:2770324
PubChem ID:14795647
Update Time:2025-04-21
1-Chloroethyl oxan-4-yl carbonate Chemical and Physical Properties
Names and Identifiers
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- 1-Chloroethyl oxan-4-yl carbonate
- SCHEMBL6580932
- DTXSID00564152
- 131801-45-1
-
- Inchi： 1S/C8H13ClO4/c1-6(9)12-8(10)13-7-2-4-11-5-3-7/h6-7H,2-5H2,1H3
- InChI Key： LBVUVJVPCNEFMC-UHFFFAOYSA-N
- SMILES： ClC(C)OC(=O)OC1CCOCC1
Computed Properties
- Exact Mass: 208.0502366Da
- Monoisotopic Mass: 208.0502366Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 168
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2
- Topological Polar Surface Area: 44.8?2
1-Chloroethyl oxan-4-yl carbonate Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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