Cas no 646526-39-8 (Cyclohexanol, 1,3-dimethyl-, (1S,3R)-)
646526-39-8 structure
Product Name:Cyclohexanol, 1,3-dimethyl-, (1S,3R)-
CAS No:646526-39-8
MF:C8H16O
MW:128.212042808533
CID:419517
PubChem ID:22214766
Update Time:2025-04-19
Cyclohexanol, 1,3-dimethyl-, (1S,3R)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanol, 1,3-dimethyl-, (1S,3R)-
- (1S,3R)-1,3-Dimethylcyclohexanol
- (A+/-)-trans-1,3-dimethyl-cyclohexanol
- DTXSID30623448
- (1S,3R)-1,3-Dimethylcyclohexan-1-ol
- SCHEMBL10089211
- 646526-39-8
-
- Inchi： 1S/C8H16O/c1-7-4-3-5-8(2,9)6-7/h7,9H,3-6H2,1-2H3/t7-,8+/m1/s1
- InChI Key： DWUSBTCQAFWLIW-SFYZADRCSA-N
- SMILES： O[C@@]1(C)CCC[C@@H](C)C1
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: 0
- Complexity: 101
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
Cyclohexanol, 1,3-dimethyl-, (1S,3R)- Related Literature
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
646526-39-8 (Cyclohexanol, 1,3-dimethyl-, (1S,3R)-) Related Products
- 110-03-2(2,5-Dimethyl-2,5-hexanediol)
- 707-37-9(3,5-Dimethyl-1-adamantanol)
- 20601-38-1(4,4'-Bicyclohexanol)
- 768-95-6(1-Adamantanol)
- 78-69-3(3,7-dimethyloctan-3-ol)
- 4534-74-1(trans-4-Ethylcyclohexanol)
- 589-91-3(4-methylcyclohexan-1-ol)
- 702-98-7(2-Methyl-2-adamantanol)
- 1940-18-7(1-Ethylcyclohexanol)
- 590-67-0(1-Methylcyclohexanol)
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