(R)-2-Nitro-α-methylbenzylamine Hydrochloride - CAS 1431699-56-7
Catalog: |
BB058755 |
Product Name: |
(R)-2-Nitro-α-methylbenzylamine Hydrochloride |
CAS: |
1431699-56-7 |
Synonyms: |
(αR)-α-Methyl-2-nitrobenzenemethanamine Hydrochloride (1:1) |
IUPAC Name: | (1R)-1-(2-nitrophenyl)ethanaminehydrochloride |
Description: | 2-Nitro-α-methyl-benzylamine Hydrochloride, can be used in the construction of Nitroaromatic Peprides, such as N-substituted glycine oligomers, or peptiods, that have shown to have important applications for the study of biomolecular interaction, and also for their use as therapeutic agents. |
Molecular Weight: | 166.18 |
Molecular Formula: | C8H10N2O2 |
Canonical SMILES: | CC(C1=CC=CC=C1[N+](=O)[O-])N.Cl |
InChI: | InChI=1S/C8H10N2O2.ClH/c1-6(9)7-4-2-3-5-8(7)10(11)12/h2-6H,9H2,1H31H/t6-/m1./s1 |
InChI Key: | HFXVLGOYQIKRTO-FYZOBXCZSA-N |
References: | Foeler, S. A., et al. J. Org. Chem., 74, 1440 (2009). |
Complexity: | 167 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.0509053 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.0509053 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 71.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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