N-Boc-1,12-dodecanediamine - CAS 109792-60-1
Catalog: |
BB002542 |
Product Name: |
N-Boc-1,12-dodecanediamine |
CAS: |
109792-60-1 |
Synonyms: |
tert-butyl N-(12-aminododecyl)carbamate |
IUPAC Name: | tert-butyl N-(12-aminododecyl)carbamate |
Description: | 12-(tert-Butoxycarbonylamino)dodecylamine can be used to synthesize inhibitors of topoisomerase I for use as anticancer agents. |
Molecular Weight: | 300.48 |
Molecular Formula: | C17H36N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NCCCCCCCCCCCCN |
InChI: | InChI=1S/C17H36N2O2/c1-17(2,3)21-16(20)19-15-13-11-9-7-5-4-6-8-10-12-14-18/h4-15,18H2,1-3H3,(H,19,20) |
InChI Key: | ZFSCBYAYUUFEPJ-UHFFFAOYSA-N |
Boiling Point: | 409.2 °C at 760 mmHg |
Purity: | 95 % |
Density: | 0.924 g/cm3 |
Storage: | Keep in dark place, Sealed in dry, 2-8 °C |
LogP: | 5.46200 |
Publication Number | Title | Priority Date |
EP-3250248-B1 | Supramolecular polymer blend | 20150130 |
EP-3560526-A1 | Supramolecular polymer blend | 20150130 |
US-2018015202-A1 | Supramolecular polymer blend | 20150130 |
US-10905796-B2 | Supramolecular polymer blend | 20150130 |
AU-2014268565-A1 | Compositions and methods comprising a polyamine | 20130522 |
Complexity: | 250 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 300.277678395 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 300.277678395 |
Rotatable Bond Count: | 14 |
Topological Polar Surface Area: | 64.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.7 |
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