Cas no 29210-77-3 (7-Octene-2,6-diol,2,6-dimethyl-)
29210-77-3 structure
Product Name:7-Octene-2,6-diol,2,6-dimethyl-
CAS No:29210-77-3
MF:C10H20O2
MW:172.264603614807
CID:240289
PubChem ID:120154
Update Time:2025-04-19
7-Octene-2,6-diol,2,6-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 7-Octene-2,6-diol,2,6-dimethyl-
- 3-hydroxydihydromyrcenol
- 1-Octen-3,7-diol, 3,7-dimethyl
- 2,6-Dimethyl-7-octen-2,6-diol
- 2,6-Dimethyl-7-octene-2,6-diol
- 2,6-Dimethyloct-7-en-2,6-diol
- 2,6-dimethyloct-7-ene-2,6-diol
- 3,7-Dimethyl-1-octen-3,7-diol
- 3,7-dimethyl-1-octene-3,7-diol
- 3,7-Dimethyl-3,7-dihydroxyoct-1-ene
- 3,7-Dimethyloct-1-ene-3,7-diol
- 6,7-Dihydro-7-hydroxylinalool
- 7-Hydroxy-6,7-dihydrolinalool
- linalool hydrate
- EINECS 260-961-9
- 7-Octene-2,6-diol, 2,6-dimethyl-
- cis-linalool hydrate
- DTXSID10880698
- EINECS 249-511-2
- NS00051373
- CHEBI:179552
- SCHEMBL4118679
- UNII-F7S8KYN9GG
- SRPFYGUVQUDURC-UHFFFAOYSA-N
- 29210-77-3
- (1)-2,6-Dimethyloct-7-ene-2,6-diol
- F7S8KYN9GG
- AKOS015841432
-
- Inchi： 1S/C10H20O2/c1-5-10(4,12)8-6-7-9(2,3)11/h5,11-12H,1,6-8H2,2-4H3
- InChI Key： SRPFYGUVQUDURC-UHFFFAOYSA-N
- SMILES： OC(C)(C)CCCC(C=C)(C)O
Computed Properties
- Exact Mass: 172.1464
- Monoisotopic Mass: 172.146
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 5
- Complexity: 152
- 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: 1.4
- Topological Polar Surface Area: 40.5?2
Experimental Properties
- Density: 0.937
- Boiling Point: 283.9°C at 760 mmHg
- Flash Point: 129.4°C
- Refractive Index: 1.468
- PSA: 40.46
- LogP: 1.86460
7-Octene-2,6-diol,2,6-dimethyl- Related Literature
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
-
Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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