2-Aminopentan-3-one Hydrochloride - CAS 79851-68-6
Catalog: |
BB054812 |
Product Name: |
2-Aminopentan-3-one Hydrochloride |
CAS: |
79851-68-6 |
Synonyms: |
2-amino-3-pentanone hydrochloride; 2-aminopentan-3-one; hydrochloride; 2-Aminopentan-3-one hydrochloride; 2-Amino-pentan-3-one hydrochloride |
IUPAC Name: | 2-aminopentan-3-onehydrochloride |
Molecular Weight: | 101.15 + 36.46 |
Molecular Formula: | C5H11NO·HCl |
Canonical SMILES: | CCC(=O)C(C)N.Cl |
InChI: | InChI=1S/C5H11NO.ClH/c1-3-5(7)4(2)6/h4H,3,6H2,1-2H31H |
InChI Key: | ZOONXWJXDICFEU-UHFFFAOYSA-N |
Complexity: | 70.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 137.0607417 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 137.0607417 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 43.1Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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