| CAS Number | 212143-39-0 |
| Catalog Number | AG00I42B(AGN-PC-0WG4A7) |
| Chemical Name | Dimethyl 2,2'-((2-((Tert-Butoxycarbonyl)Amino)Ethyl)Azanediyl)Diacetate |
| IUPAC Name | methyl 2-[(2-methoxy-2-oxoethyl)-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]amino]acetate |
| InChI | InChI=1S/C13H24N2O6/c1-13(2,3)21-12(18)14-6-7-15(8-10(16)19-4)9-11(17)20-5/h6-9H2,1-5H3,(H,14,18) |
| InChI Key | KHKIDQBDSLQVGI-UHFFFAOYSA-N |
| MDL Number | MFCD29917059 |
| Molecular Formula | C13H24N2O6 |
| Molecular Weight | 304.3395 |
| SMILES | COC(=O)CN(CCNC(=O)OC(C)(C)C)CC(=O)OC |
| Synonyms | 212143-39-0,
Dimethyl 2,2'-((2-((tert-butoxycarbonyl)amino)ethyl)azanediyl)diacetate,
MFCD29917059,
ZINC306145205,
TZ001218,
CS-0037084,
Dimethyl 2,2'-((2-((t-butoxycarbonyl)amino)ethyl)azanediyl)diacetate,
DIMETHYL 2,2-((2-((TERT-BUTOXYCARBONYL)AMINO)ETHYL)AZANEDIYL)DIACETATE,
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| Complexity | 346 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 304.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 304.343g/mol |
| Monoisotopic Mass | 304.163g/mol |
| Rotatable Bond Count | 11 |
| Topological Polar Surface Area | 94.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number