ChemicalBook--->CAS DataBase List--->17768-41-1

17768-41-1

17768-41-1 Structure

17768-41-1 Structure
IdentificationMore
[Name]

1-Adamantanemethylamine
[CAS]

17768-41-1
[Synonyms]

1-ADAMANTANEMETHYLAMINE
1-ADAMANTYLMETHYLAMINE
1-ADMA
1-AMINOMETHYLADAMANTANE
AKOS B014406
AKOS BC-0196
1-Adamantylmethanamine
Tricyclo[3.3.1.1(3,7)-]decane-1-methanamine
tricyclo(3.3.1.13,7)dec-1-ylmethylamine
1-aminomethyl adamantine
N-(1-Adamantyl)-N-methylamine
1-ADAMANTANEMETHYLAMINE 98%
1-Adamantanemethylamine
C-ADAMANTAN-1-YL-METHYLAMINE
1-(1-Adamantyl)methanamine
1-(Aminomethyl)tricyclo[3.3.1.13,7]decane
1-Adamantanemethanamine
Mrz-2/16
[EINECS(EC#)]

241-752-1
[Molecular Formula]

C11H19N
[MDL Number]

MFCD00074750
[Molecular Weight]

165.28
[MOL File]

17768-41-1.mol
Chemical PropertiesBack Directory
[Appearance]

clear colourless to very slightly yellow liquid
[Boiling point ]

83-85 °C/0.3 mmHg (lit.)
[density ]

0.933 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.5137(lit.)
[Fp ]

198 °F
[storage temp. ]

2-8°C(protect from light)
[form ]

Liquid
[pka]

10.71±0.29(Predicted)
[color ]

Colorless to pale yellow
[Sensitive ]

Air Sensitive
[InChI]

1S/C11H19N/c12-7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-7,12H2/t8-,9+,10-,11-
[InChIKey]

XSOHXMFFSKTSIT-BIBSGERRSA-N
[SMILES]

NCC12C[C@H]3C[C@H](C[C@H](C3)C1)C2
[CAS DataBase Reference]

17768-41-1(CAS DataBase Reference)
[NIST Chemistry Reference]

1-Adamantanemethylamine(17768-41-1)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)
GHS05
[Signal word ]

Danger
[Hazard statements ]

H314
[Precautionary statements ]

P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
[Hazard Codes ]

Xi,C
[Risk Statements ]

R34:Causes burns.
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S27:Take off immediately all contaminated clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[RIDADR ]

UN 2735
[WGK Germany ]

3
[HazardClass ]

8
[HazardClass ]

IRRITANT
[HS Code ]

29213000
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Eye Dam. 1
Skin Corr. 1B
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Sodium hydroxide-->Tetrahydrofuran-->Dichloromethane-->Thionyl chloride-->Chloroform-->Magnesium sulfate-->Ammonium hydroxide-->Lithium Aluminum Hydride-->Benzaldehyde-->1-Adamantanecarboxylic acid
[Preparation Products]

1-Methyladamantane-->2-[(Adamantan-1-ylmethyl)-amino]-ethanol
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1-Adamantanemethylamine(17768-41-1).msds
Hazard InformationBack Directory
[Chemical Properties]

clear colourless to very slightly yellow liquid
[Uses]

Adamantan-1-ylmethanamine (1-Aminomethyladamantane) is a Hyt hydrophobic group. Adamantan-1-ylmethanamine can be used in the synthesis of ZX782 (HY-161972)[1].
[General Description]

1-Adamantanemethylamine is a large amine present on the wall of 6,7-diaminoquinoxaline. The thermodynamic complex formation constant of 1-adamantanemethylamine was studied.
[Purification Methods]

Dissolve the amine in Et2O, dry over KOH and distil it. The N-Tosyl derivative has m 134-135o (from EtOH). [Stetter & Goebel Chem Ber 96 550 1963.]
[References]

[1] Li X, et al. Design, Synthesis, and Biological Evaluation of Hydrophobic-Tagged Glutathione Peroxidase 4 (GPX4) Degraders. Bioorg Chem. 2024 Mar;144:107115. DOI:10.1016/j.bioorg.2024.107115
Spectrum DetailBack Directory
[Spectrum Detail]

1-Adamantanemethylamine(17768-41-1)1HNMR
1-Adamantanemethylamine(17768-41-1)IR1
1-Adamantanemethylamine(17768-41-1)IR2
1-Adamantanemethylamine(17768-41-1)IR3
1-Adamantanemethylamine(17768-41-1)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1-Adamantanemethylamine, 98%(17768-41-1)
[Sigma Aldrich]

17768-41-1(sigmaaldrich)
[TCI AMERICA]

1-Adamantanemethylamine,>98.0%(GC)(T)(17768-41-1)
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