| CAS Number | 2100306-49-6 |
| Catalog Number | AG019EBW |
| Chemical Name | 10-(2-(2-(Prop-2-Yn-1-Yloxy)Ethoxy)Ethyl)-4,7,13,16-Tetraoxa-10-Azanonadec-18-Ynoic Acid |
| IUPAC Name | 3-[2-[2-[bis[2-(2-prop-2-ynoxyethoxy)ethyl]amino]ethoxy]ethoxy]propanoic acid |
| InChI | InChI=1S/C21H35NO8/c1-3-9-25-15-18-28-12-6-22(7-13-29-19-16-26-10-4-2)8-14-30-20-17-27-11-5-21(23)24/h1-2H,5-20H2,(H,23,24) |
| InChI Key | JVZDIWKKKCXHEA-UHFFFAOYSA-N |
| MDL Number | MFCD30723247 |
| Molecular Formula | C21H35NO8 |
| Molecular Weight | 429.5045 |
| SMILES | C(C#C)OCCOCCN(CCOCCOCCC(=O)O)CCOCCOCC#C |
| Synonyms | N-(Acid-PEG2)-N-bis(PEG2-propargyl),
2100306-49-6,
BP-23550,
|
| Complexity | 466 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 429.236g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 30 |
| Hydrogen Bond Acceptor Count | 9 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 429.51g/mol |
| Monoisotopic Mass | 429.236g/mol |
| Rotatable Bond Count | 23 |
| Topological Polar Surface Area | 95.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number