| CAS Number | 1310686-23-7 |
| Catalog Number | AG019E3V |
| Chemical Name | 1-Isothiocyanato-PEG3-azide |
| IUPAC Name | 1-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]-2-isothiocyanatoethane |
| InChI | InChI=1S/C9H16N4O3S/c10-13-12-2-4-15-6-8-16-7-5-14-3-1-11-9-17/h1-8H2 |
| InChI Key | WGVGUDRBZOFJRC-UHFFFAOYSA-N |
| MDL Number | MFCD29052172 |
| Molecular Formula | C9H16N4O3S |
| Molecular Weight | 260.3133 |
| SMILES | S=C=NCCOCCOCCOCCN=[N+]=[N-] |
| Synonyms | 1-isothiocyanato-PEG3-Azide,
SCHEMBL16468520,
BP-22971,
1310686-23-7,
|
| Complexity | 265 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 260.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.312g/mol |
| Monoisotopic Mass | 260.094g/mol |
| Rotatable Bond Count | 12 |
| Topological Polar Surface Area | 86.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number