| CAS Number | 1802908-05-9 |
| Catalog Number | AG00I012(AGN-PC-0WR278) |
| Chemical Name | 2-(2-(2-(2-(4-(6-Methyl-1,2,4,5-Tetrazin-3-Yl)Phenoxy)Ethoxy)Ethoxy)Ethoxy)Ethanamine |
| IUPAC Name | 2-[2-[2-[2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy]ethoxy]ethoxy]ethanamine |
| InChI | InChI=1S/C17H25N5O4/c1-14-19-21-17(22-20-14)15-2-4-16(5-3-15)26-13-12-25-11-10-24-9-8-23-7-6-18/h2-5H,6-13,18H2,1H3 |
| InChI Key | JOEAATMYJGXMGS-UHFFFAOYSA-N |
| MDL Number | MFCD28334553 |
| Molecular Formula | C17H25N5O4 |
| Molecular Weight | 363.4115 |
| SMILES | CC1=NN=C(N=N1)C1=CC=C(OCCOCCOCCOCCN)C=C1 |
| Synonyms | Methyltetrazine-PEG4-Amine,
1802908-05-9,
Methyltetrazine-PEG4-amine HCl salt,
BP-22435,
|
| Complexity | 337 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 363.191g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 9 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 363.418g/mol |
| Monoisotopic Mass | 363.191g/mol |
| Rotatable Bond Count | 13 |
| Topological Polar Surface Area | 115A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.7 |
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Certificate of Analysis
Lot Number