N-Trifluoroacetyl-1,3-propylenediamine Hydrochloride - CAS 1346604-02-1
Catalog: |
BB057257 |
Product Name: |
N-Trifluoroacetyl-1,3-propylenediamine Hydrochloride |
CAS: |
1346604-02-1 |
Synonyms: |
N-(3-Aminopropyl)-2,2,2-trifluoroacetamide Hydrochloride; Mono N-Trifluoroacetyl Diaminopropane Hydrochloride |
IUPAC Name: | N-(3-aminopropyl)-2,2,2-trifluoroacetamidehydrochloride |
Description: | Used in the preparation of aminoalkylphosphoramidate linkage-containing oligonucleotide derivatives, |
Molecular Weight: | 206.59 |
Molecular Formula: | C5H10ClF3N2O |
Canonical SMILES: | C(CN)CNC(=O)C(F)(F)F.Cl |
InChI: | InChI=1S/C5H9F3N2O.ClH/c6-5(7,8)4(11)10-3-1-2-9/h1-3,9H2,(H,10,11)1H |
InChI Key: | QTNUPWKEDQOSGU-UHFFFAOYSA-N |
References: | Marini, F., et al. J. Biol. Chem., 278, 32014 (2003), Takata, K., et al. J. Biol .Chem., 281, 23445 (2006), Minko, I., et al. Mutat. Res. 637, 161 (2008),. |
Complexity: | 134 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.0433751 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.0433751 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 55.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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