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138053

1-Adamantanecarbonitrile

Name: 1-Adamantanecarbonitrile
Brand: ALDRICH

97%

Synonym(s):

1-Cyanoadamantane

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About This Item

Empirical Formula (Hill Notation):

C₁₁H₁₅N

CAS Number:

23074-42-2

Molecular Weight:

161.24

NACRES:

NA.22

PubChem Substance ID:

24848231

UNSPSC Code:

12352100

EC Number:

245-413-9

MDL number:

MFCD00074731

Assay:

97%

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Properties

Quality Level

100

assay

97%

mp

193-196 °C (lit.)

SMILES string

N#CC12CC3CC(CC(C3)C1)C2

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-

InChI key

FQFZASRJFRAEIH-BIBSGERRSA-N

Description

General description

1-Adamantanecarbonitrile reacts with W₂(OCMe₃)₆to yield W(CAd)(OCMe₃)₃ (Ad=1-adamantyl).

Application

1-Adamantanecarbonitrile was used as starting reagent for the synthesis of adamantyl-l,3,4-oxathiazol-2-one.

pictograms

GHS07

signalword

Warning

hcodes

H302 + H312

pcodes

P264 - P280 - P301 + P312 - P302 + P352 + P312 - P362 + P364 - P501

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Oral

Storage Class

11 - Combustible Solids

wgk

WGK 3

ppe

dust mask type N95 (US), Eyeshields, Gloves

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The selective complexation of adamantane nitriles by tungsten pentacarbonyl.

Jefford VJ, et al.

Canadian Journal of Chemistry, 74(1), 107-113 (1996)

α-Hydrogen migration reactions in tungsten (VI) cyclopentadienyl alkylidyne complexes.

Warren TH, et al.

Journal of Organometallic Chemistry, 569(1), 125-137 (1998)

Global Trade Item Number

SKU	GTIN
138053-5G	04061832098012