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Structure

1-Adamantanecarbonitrile

CAS
23074-42-2
Catalog Number
ACM23074422
Category
Other Products
Molecular Weight
161.24
Molecular Formula
C11H15N

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Specification

Synonyms
1-Adamantanecarbonitrile, 1-Cyanoadamantane, 1-Adamantylnitrile, 1-Adamantyl cyanide, Ambap5977, adamantane-1-carbonitrile, ADAMANTANE,1-CYANO, 138053_ALDRICH, 1-Adamantane carboxylic acid nitrile, EINECS 245-413-9, NSC137842, SBB016031, ZINC01271107, Tricyclo[3.3.1.1(3,7)]decane-1-carbonitrile, Tricyclo(3.3.1.13,7)decane-1-carbonitrile, Tricyclo[3.3.1.13,7]decane-1-carbonitrile, tricyclo[3.3.1.1~3,7~]decane-1-carbonitrile, 23074-42-2, InChI=1/C11H15N/c12-7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-6H
IUPAC Name
adamantane-1-carbonitrile
Canonical SMILES
C1C2CC3CC1CC(C2)(C3)C#N
InChI Key
FQFZASRJFRAEIH-UHFFFAOYSA-N
Boiling Point
274.5ºC at 760 mmHg
Melting Point
193-197ºC
Flash Point
110.9ºC
Density
1.07g/cm³
Appearance
white granular powder
EC Number
245-413-9
Exact Mass
161.12000
Hazard Statements
Xn:Harmful;
H-Bond Acceptor
1
H-Bond Donor
0
Packing Group
III
Safety Description
S23
WGK Germany
3
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