Methyltetrazine-PEG12-amine HCl salt

Catalog Number	R08-0040
Category	Tetrazines
Molecular Formula	C33H58ClN5O12
Molecular Weight	752.3

Catalog Number	Size	Price	Quantity
R08-0040	--	$--

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Product Introduction

Methyltetrazine-PEG12-Amine-HCl salt is an aqueous souluble PEG linker containing a free amine and a methyltetrazine group. Methyl group improves the stability and hydrophilic PEG spacer increases water-solubility. Methyltetrazine enable fast click reaction with TCO (trans-cycloctene), the amine (NH2) group is reactive with carboxylic acid containing molecule in the presence of reagnet such as EDC or HATU.

Chemical Information
Purity	96%
IUPAC Name	2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
Canonical SMILES	CC1=NN=C(N=N1)C2=CC=C(C=C2)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN
InChI	InChI=1S/C33H57N5O12/c1-30-35-37-33(38-36-30)31-2-4-32(5-3-31)50-29-28-49-27-26-48-25-24-47-23-22-46-21-20-45-19-18-44-17-16-43-15-14-42-13-12-41-11-10-40-9-8-39-7-6-34/h2-5H,6-29,34H2,1H3
InChI Key	OOYKOEQEEWHQMP-UHFFFAOYSA-N
Solubility	Water, DMSO, DCM, DMF

Product Specification

Storage

-20 °C

Computed Properties
XLogP3	-1.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	17
Rotatable Bond Count	37
Exact Mass	715.40037227 g/mol
Monoisotopic Mass	715.40037227 g/mol
Topological Polar Surface Area	188Å²
Heavy Atom Count	50
Formal Charge	0
Complexity	696
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Applications of Fluorescent Probes & Dyes

Laser Dye

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Methyltetrazine-PEG12-amine HCl salt

Product Introduction

Chemical Information

Computed Properties