Cas no 30572-96-4 (1,2-Cyclodecanediol,(1R,2S)-rel-)
30572-96-4 structure
Product Name:1,2-Cyclodecanediol,(1R,2S)-rel-
CAS No:30572-96-4
MF:C10H20O2
MW:172.264603614807
CID:317620
PubChem ID:141572
Update Time:2025-04-19
1,2-Cyclodecanediol,(1R,2S)-rel- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Cyclodecanediol,(1R,2S)-rel-
- cyclodecane-1,2-diol
- DTXSID30952861
- 30572-96-4
- SCHEMBL1774812
- cis-1,2-Cyclodecanediol
-
- Inchi： 1S/C10H20O2/c11-9-7-5-3-1-2-4-6-8-10(9)12/h9-12H,1-8H2
- InChI Key： NVGYZORHPOIGFP-UHFFFAOYSA-N
- SMILES： OC1CCCCCCCCC1O
Computed Properties
- Exact Mass: 172.1464
- Monoisotopic Mass: 172.14633
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 100
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 40.5
- XLogP3: 2.4
Experimental Properties
- Density: 1.005
- Boiling Point: 303.8°Cat760mmHg
- Flash Point: 143.2°C
- Refractive Index: 1.487
- PSA: 40.46
1,2-Cyclodecanediol,(1R,2S)-rel- Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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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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