Cas no 55944-43-9 (1-Heptyne, 3-ethyl-)
1-Heptyne, 3-ethyl- structure
Product Name:1-Heptyne, 3-ethyl-
CAS No:55944-43-9
MF:C9H16
MW:124.223342895508
CID:350250
PubChem ID:11412373
Update Time:2025-04-19
1-Heptyne, 3-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1-Heptyne, 3-ethyl-
- 3-ethylhept-1-yne
- 3-Ethyl-hept-1-yne
- ZSFABVOIAIIPSQ-UHFFFAOYSA-N
- 3-ethyl-1-heptyne
- DTXSID60464982
- 55944-43-9
-
- Inchi： 1S/C9H16/c1-4-7-8-9(5-2)6-3/h2,9H,4,6-8H2,1,3H3
- InChI Key： ZSFABVOIAIIPSQ-UHFFFAOYSA-N
- SMILES： C(CCC)C(C#C)CC
Computed Properties
- Exact Mass: 124.12528
- Monoisotopic Mass: 124.125200510g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 93.9
- 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: 3.8
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
1-Heptyne, 3-ethyl- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
55944-43-9 (1-Heptyne, 3-ethyl-) Related Products
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