| Identification | More | [Name]
1-Adamantanecarbonitrile | [CAS]
23074-42-2 | [Synonyms]
1-ADAMANTANECARBONITRILE
1-ADAMANTYL CYANIDE
1-CYANOADAMANTANE
ADAMANTANE-1-CARBONITRILE
AKOS BC-0472
IFLAB-BB F1928-0022
LABOTEST-BB LT00007841
RARECHEM AQ TC 1003
1-Adamantancarbonsαurenitril
1-Adamantane carboxylic acid nitrile
1-Adamantanecarboxylicacidnitrile
1-Adamantylnitrile
1-Cyanadamantan
Tricyclo[3.3.1.1(3,7)]decane-1-carbonitrile
Tricyclo[3.3.1.13,7]decane-1-carbonitrile
1-ADAMANTANECARBONITRILE, 99+% | [EINECS(EC#)]
245-413-9 | [Molecular Formula]
C11H15N | [MDL Number]
MFCD00074731 | [Molecular Weight]
161.24 | [MOL File]
23074-42-2.mol |
| Chemical Properties | Back Directory | [Appearance]
white granular powder | [Melting point ]
193-196 °C(lit.) | [Boiling point ]
277.57°C (rough estimate) | [density ]
0.9100 (rough estimate) | [refractive index ]
1.4600 (estimate) | [storage temp. ]
Storage temp. 2-8°C | [solubility ]
soluble in Benzene,Methanol,Ethanol | [form ]
powder to crystal | [color ]
White to Light yellow | [Exposure limits]
NIOSH: IDLH 25 mg/m3 | [InChI]
1S/C11H15N/c12-7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-6H2/t8-,9+,10-,11- | [InChIKey]
FQFZASRJFRAEIH-BIBSGERRSA-N | [SMILES]
N#CC12CC3CC(CC(C3)C1)C2 | [CAS DataBase Reference]
23074-42-2(CAS DataBase Reference) | [NIST Chemistry Reference]
Tricyclo[3.3.1.13,7]decane-1-carbonitrile(23074-42-2) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn,Xi | [Risk Statements ]
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R20/21:Harmful by inhalation and in contact with skin .
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S36:Wear suitable protective clothing .
S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . | [RIDADR ]
3276 | [WGK Germany ]
3
| [HazardClass ]
6.1 | [PackingGroup ]
III | [HS Code ]
29269090 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Dermal
Acute Tox. 4 Oral |
| Hazard Information | Back Directory | [Chemical Properties]
white granular powder | [Uses]
1-Adamantanecarbonitrile was used as starting reagent for the synthesis of adamantyl-l,3,4-oxathiazol-2-one. | [Synthesis Reference(s)]
The Journal of Organic Chemistry, 45, p. 5239, 1980 DOI: 10.1021/jo01314a003
Synthesis, p. 1140, 1985 DOI: 10.1055/s-1985-31453 | [General Description]
1-Adamantanecarbonitrile reacts with W2(OCMe3)6 to yield W(CAd)(OCMe3)3 (Ad=1-adamantyl). |
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