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62087-82-5

62087-82-5 Structure

62087-82-5 Structure
IdentificationBack Directory
[Name]

1-ADAMANTYLOXYCARBONYL FLUORIDE
[CAS]

62087-82-5
[Synonyms]

ADOC-F
1-ADOC-F
ADAMANTYL FLUOROFORMATE
1-ADAMANTYL FLUOROFORMATE
1-ADAMANTYLOXYCARBONYL FLUORIDE
1-ADAMANTYL FLUOROFORMATE, 90+%
Adamantan-1-yl carbonofluoridate
1-Adamantyl carbonofluoridic acid
Fluoroformic acid adamantan-1-yl ester
Fluoridocarbonic acid 1-adamantyl ester
(tricyclo(3,3,1,1,3,7)decan-1-yl) fluoroformate
Fluoroformic acid tricyclo[3.3.1.13,7]decan-1-yl ester
Carbonofluoridic acid,tricyclo[3.3.1.13,7]dec-1-yl ester
[EINECS(EC#)]

263-400-6
[Molecular Formula]

C11H15FO2
[MDL Number]

MFCD00074772
[MOL File]

62087-82-5.mol
[Molecular Weight]

198.23
Chemical PropertiesBack Directory
[Melting point ]

30-32 °C (lit.)
[Fp ]

192 °F
[storage temp. ]

2-8°C
[form ]

solid
[BRN ]

3590131
[Major Application]

peptide synthesis
[InChI]

1S/C11H15FO2/c12-10(13)14-11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9H,1-6H2/t7-,8+,9-,11-
[InChIKey]

PNLZKVOKOVFGMZ-KJZNFTALSA-N
[SMILES]

FC(=O)OC12C[C@H]3C[C@H](C[C@H](C3)C1)C2
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

34
[Safety Statements ]

26-36/37/39-45
[RIDADR ]

UN 2921 8/PG 1
[WGK Germany ]

3
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Skin Corr. 1B
Hazard InformationBack Directory
[Uses]

peptide synthesis
[Purification Methods]

Dissolve it in n-hexane (ca 10g in 150 mL) and keep at 0o for 24hours. Any 1-adamantanol present will separate. Filter and evaporate to dryness. The crystalline residue has m 31-32o and is recrystallised from n-hexane (90g/500mL), (IR (KBr): max 1242, 1824 and 2340 cm-1). There should be no OH str band above 2500 cm-1. [Moroder et al. Hoppe-Seyler’s Z Physiol Chem 357 1647 1976, cf Haas et al. J Am Chem Soc 88 1988 1966.]
Spectrum DetailBack Directory
[Spectrum Detail]

1-ADAMANTYLOXYCARBONYL FLUORIDE(62087-82-5)MS
1-ADAMANTYLOXYCARBONYL FLUORIDE(62087-82-5)1HNMR
1-ADAMANTYLOXYCARBONYL FLUORIDE(62087-82-5)IR1
1-ADAMANTYLOXYCARBONYL FLUORIDE(62087-82-5)IR2
1-ADAMANTYLOXYCARBONYL FLUORIDE(62087-82-5)Raman
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