ChemicalBook--->CAS DataBase List--->1092689-33-2

1092689-33-2

1092689-33-2 Structure

1092689-33-2 Structure
IdentificationBack Directory
[Name]

(4-(1,2,4,5-tetrazin-3-yl)phenyl)methanamine HCL
[CAS]

1092689-33-2
[Synonyms]

Tetrazine-Amine
Tetrazine – Amine, HCl salt
Tetrazine - Amine - TFA-salt
3-(4-benzylamino)-1,2,4,5-tetrazine
3-(p-benzylamino)-1,2,4,5-tetrazine
3-[4-(aminomethyl)phenyl]-1,2,4,5-tetrazine
4-(1,2,4,5-tetrazin-3-yl)benzenemethanamine
1-[4-(1,2,4,5-tetrazin-3-yl)phenyl]methanamine
Benzenemethanamine, 4-(1,2,4,5-tetrazin-3-yl)-
(4-(1,2,4,5-tetrazin-3-yl)phenyl)methanamine HCL
4-(1,2,4,5-tetrazin-3-yl)benzenemethanamine hydrochloride
[Molecular Formula]

C9H9N5
[MDL Number]

MFCD20275288
[MOL File]

1092689-33-2.mol
[Molecular Weight]

187.2
Chemical PropertiesBack Directory
[Boiling point ]

403.4±47.0 °C(Predicted)
[density ]

1.268±0.06 g/cm3(Predicted)
[pka]

8.31±0.10(Predicted)
[InChI]

InChI=1S/C9H9N5/c10-5-7-1-3-8(4-2-7)9-13-11-6-12-14-9/h1-4,6H,5,10H2
[InChIKey]

JGCOJRPYFRRONJ-UHFFFAOYSA-N
[SMILES]

C1(CN)=CC=C(C2=NN=CN=N2)C=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
Hazard InformationBack Directory
[Uses]

Tetrazine-Amine is a tetrazine linker that can be used to covalently label live cells through a cycloaddition[1][2]. Tetrazine-Amine is a click chemistry reagent, it contains a Tetrazine group that can undergo an inverse electron demand Diels-Alder reaction (iEDDA) with molecules containing TCO groups.
[References]

[1] Devaraj NK, et, al. Fast and sensitive pretargeted labeling of cancer cells through a tetrazine/trans-cyclooctene cycloaddition. Angew Chem Int Ed Engl. 2009;48(38):7013-6. DOI:10.1002/anie.200903233
[2] Devaraj NK, et, al. Tetrazine-based cycloadditions: application to pretargeted live cell imaging. Bioconjug Chem. 2008 Dec;19(12):2297-9. DOI:10.1021/bc8004446
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