Cas no 89489-28-1 (Tert-butoxyacetylene)
Tert-butoxyacetylene structure
Product Name:Tert-butoxyacetylene
CAS No:89489-28-1
MF:C6H10O
MW:98.1430020332336
CID:2811735
PubChem ID:10898653
Update Time:2025-04-21
Tert-butoxyacetylene Chemical and Physical Properties
Names and Identifiers
-
- 2-ethynoxy-2-methylpropane
- T-BUTOXYACETYLENE
- Propane, 2-(ethynyloxy)-2-methyl-
- DTXCID00398338
- DTXSID00447517
- t-butoxyethyne
- tert-butyl ethynyl ether
- 2-(ETHYNYLOXY)-2-METHYLPROPANE
- 89489-28-1
- TERT-BUTOXYACETYLENE
- Tert-butoxyacetylene
-
- Inchi： 1S/C6H10O/c1-5-7-6(2,3)4/h1H,2-4H3
- InChI Key： POYDIZHDEOYYAN-UHFFFAOYSA-N
- SMILES： O(C#C)C(C)(C)C
Computed Properties
- Exact Mass: 98.073164938Da
- Monoisotopic Mass: 98.073164938Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 7
- Rotatable Bond Count: 2
- Complexity: 88.5
- 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: 1.7
- Topological Polar Surface Area: 9.2?2
Tert-butoxyacetylene Related Literature
-
Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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