Cas no 1892-00-8 (6-Hepten-1-ol, 6-methyl-)
6-Hepten-1-ol, 6-methyl- structure
Product Name:6-Hepten-1-ol, 6-methyl-
CAS No:1892-00-8
MF:C8H16O
MW:128.212042808533
CID:1384223
PubChem ID:13283659
Update Time:2025-04-20
6-Hepten-1-ol, 6-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 6-Hepten-1-ol, 6-methyl-
- 6-methylhept-6-en-1-ol
- DTXSID30534606
- SCHEMBL466548
- 1892-00-8
-
- Inchi： 1S/C8H16O/c1-8(2)6-4-3-5-7-9/h9H,1,3-7H2,2H3
- InChI Key： AYZDUQJSEYAYTG-UHFFFAOYSA-N
- SMILES： OCCCCCC(=C)C
Computed Properties
- Exact Mass: 128.12018
- Monoisotopic Mass: 128.120115130g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 5
- Complexity: 76.6
- 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: 2.5
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
6-Hepten-1-ol, 6-methyl- Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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