Cas no 30346-27-1 (Ethanol,2-(3,3-dimethylcyclohexylidene)-, (2E)-)
30346-27-1 structure
Product Name:Ethanol,2-(3,3-dimethylcyclohexylidene)-, (2E)-
CAS No:30346-27-1
MF:C10H18O
MW:154.249323368073
CID:309683
PubChem ID:6449789
Update Time:2025-04-19
Ethanol,2-(3,3-dimethylcyclohexylidene)-, (2E)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanol,2-(3,3-dimethylcyclohexylidene)-, (2E)-
- (2Z)-2-(3,3-dimethylcyclohexylidene)ethanol
- (E)-Grandlure II
- (E)-2-(3,3-Dimethylcyclohexylidene)ethanol
- SCHEMBL1301911
- Ethanol, 2-(3,3-dimethylcyclohexylidene)-
- Ethanol, 2-(3,3-dimethylcyclohexylidene)-, (2E)-
- SCHEMBL1301909
- EINECS 255-336-2
- DTXSID40885474
- 30346-27-1
- delta1,beta-Cyclohexaneethanol, 3,3-dimethyl-
- (Z)-3,3-DIMETHYLCYCLOHEXYLIDENEETHANOL
- 41370-29-0
-
- Inchi： 1S/C10H18O/c1-10(2)6-3-4-9(8-10)5-7-11/h5,11H,3-4,6-8H2,1-2H3/b9-5+
- InChI Key： SHYLMMBHTKLAJS-WEVVVXLNSA-N
- SMILES： OC/C=C1\CCCC(C)(C)C\1
Computed Properties
- Exact Mass: 154.135765193g/mol
- Monoisotopic Mass: 154.135765193g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 156
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.2
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- Density: 0.966±0.06 g/cm3 (20 oC 760 Torr),
- Boiling Point: 212.7±8.0 oC (760 Torr),
- Flash Point: 90.0±8.3 oC,
- Refractive Index: 1.4774 (22 oC)
- Solubility: Slightly soluble (2.2 g/l) (25 o C),
Ethanol,2-(3,3-dimethylcyclohexylidene)-, (2E)- Related Literature
-
Lei Hong,Wu Jing,Wang Qing,Su Anxiang,Xue Mei,Liu Qin,Hu Qiuhui Food Funct. 2017 8 1569
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