Cas no 762-47-0 (6-Octen-3-one, 7-methyl-)
6-Octen-3-one, 7-methyl- structure
Product Name:6-Octen-3-one, 7-methyl-
6-Octen-3-one, 7-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 6-Octen-3-one, 7-methyl-
- 7-methyloct-6-en-3-one
- 7-methyl-6-octen-3-one
- DTXSID00543568
- 762-47-0
- SCHEMBL10879901
-
- Inchi： 1S/C9H16O/c1-4-9(10)7-5-6-8(2)3/h6H,4-5,7H2,1-3H3
- InChI Key： HEFCEAOQAPBGKX-UHFFFAOYSA-N
- SMILES： O=C(CC)CC/C=C(\C)/C
Computed Properties
- Exact Mass: 140.12018
- Monoisotopic Mass: 140.120115130g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 130
- 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: 2.3
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
6-Octen-3-one, 7-methyl- Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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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
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
762-47-0 (6-Octen-3-one, 7-methyl-) Related Products
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