| Identification | More | [Name]
1-Chloroadamantane | [CAS]
935-56-8 | [Synonyms]
1-ADAMANTYL CHLORIDE
1-CHLOROADAMANTANE
LABOTEST-BB LT00033850
RARECHEM AQ TC 1018
3-Chloroadamantane
7]decane,1-chloro-tricyclo[3.3.1.1
Adamantyl chloride
Tricyclo[3.3.1.13,7]decane, 1-chloro-
1-chlorotricyclo[3.3.1.13,7]decane
1-chloro-tricyclo[3.3.1.1.7]decane
Tricyclo[3.3.1.1(3,7)-]decane, 1-chloro-
9. 1-Adamantyl chloride | [EINECS(EC#)]
213-305-0 | [Molecular Formula]
C10H15Cl | [MDL Number]
MFCD00075627 | [Molecular Weight]
170.68 | [MOL File]
935-56-8.mol |
| Chemical Properties | Back Directory | [Appearance]
white to light grey adhering crystalline solid or | [Melting point ]
165-166 °C(lit.) | [Boiling point ]
211.58°C (rough estimate) | [density ]
1.0492 (rough estimate) | [refractive index ]
1.6012 (estimate) | [storage temp. ]
2-8°C | [solubility ]
DMSO, Methanol (Slightly) | [form ]
Crystalline | [color ]
Off-White | [Water Solubility ]
Poorly soluble in water. Soluble in hydrocarbons. But readily soluble in nonpolar organic solvents. | [Stability:]
Light Sensitive | [InChI]
InChI=1S/C10H15Cl/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6H2 | [InChIKey]
OZNXTQSXSHODFR-UHFFFAOYSA-N | [SMILES]
C12(Cl)CC3CC(CC(C3)C1)C2 | [CAS DataBase Reference]
935-56-8(CAS DataBase Reference) | [NIST Chemistry Reference]
Adamantane, 1-chloro-(935-56-8) | [EPA Substance Registry System]
935-56-8(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S24/25:Avoid contact with skin and eyes . | [WGK Germany ]
3
| [TSCA ]
Yes | [HS Code ]
29035980 |
| Hazard Information | Back Directory | [Chemical Properties]
white to light grey adhering crystalline solid or | [Uses]
1-Chloroadamantane was employed as precursor for the synthesis of perfluoroadmantane derivatives via aerosol direct fluorination. | [Uses]
1-Chloroadamantane, an adamantane derivative shown to exhibit virucidal activity against the Newcastle disease virus in chick embryo fibroblasts. (Adamantane EP Impurity A) | [Synthesis Reference(s)]
Synthetic Communications, 19, p. 1697, 1989 DOI: 10.1080/00397918908051068 | [General Description]
An unusual zwitterionic diradical intermediate complex was generated during the photoinduced electron-transfer substitution reaction between 1-chloroadamantane and tert-butylamine system in a hydrocarbon glass. | [Purification Methods]
Crystallise the chloride from aqueous MeOH and sublime it at 100o/12torr. It also crystallises from MeOH at -70o. [Stetter et al. Chem Ber 92 1629 1959, Schleyer & Nicholas J Am Chem Soc 83 2700 1961, Beilstein 5 IV 469.] |
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