1,9-Bis-Boc-1,5,9-triazanonane - CAS 82409-02-7
Catalog: |
BB036814 |
Product Name: |
1,9-Bis-Boc-1,5,9-triazanonane |
CAS: |
82409-02-7 |
Synonyms: |
N-[3-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propylamino]propyl]carbamic acid tert-butyl ester; tert-butyl N-[3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylamino]propyl]carbamate |
IUPAC Name: | tert-butyl N-[3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylamino]propyl]carbamate |
Description: | 1,9-Bis-Boc-1,5,9-triazanonane (CAS# 82409-02-7) is a useful research chemical compound. |
Molecular Weight: | 331.45 |
Molecular Formula: | C16H33N3O4 |
Canonical SMILES: | CC(C)(C)OC(=O)NCCCNCCCNC(=O)OC(C)(C)C |
InChI: | InChI=1S/C16H33N3O4/c1-15(2,3)22-13(20)18-11-7-9-17-10-8-12-19-14(21)23-16(4,5)6/h17H,7-12H2,1-6H3,(H,18,20)(H,19,21) |
InChI Key: | RXUZRBQIVIUOLJ-UHFFFAOYSA-N |
Appearance: | White powder |
LogP: | 3.20530 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P310, P321, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021115503-A1 | Lipophosphonoxins, their preparation and use | 20191212 |
WO-2021035310-A1 | Targeted dendrimer conjugates | 20190828 |
WO-2020213008-A1 | Small-molecular adjuvants and implementations thereof | 20190415 |
WO-2020125670-A1 | APPLICATION OF MONOCYCLIC β-LACTAM COMPOUND IN PHARMACY | 20181218 |
WO-2020064847-A1 | Degradable hyaluronic acid hydrogels | 20180926 |
Complexity: | 325 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 331.24710654 |
Formal Charge: | 0 |
Heavy Atom Count: | 23 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 331.24710654 |
Rotatable Bond Count: | 12 |
Topological Polar Surface Area: | 88.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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