Ammonium Nonanoate - CAS 63718-65-0
Catalog: |
BB054996 |
Product Name: |
Ammonium Nonanoate |
CAS: |
63718-65-0 |
Synonyms: |
Ammonium nonanoate; Ammonium pelargonate; nonanoate; Pelargonic acid ammonium salt; Nonanoic acid, ammonium salt (1:1); Nonnarcotic acid, ammonium salt |
IUPAC Name: | azaniumnonanoate |
Molecular Weight: | 158.24 + (17.03) |
Molecular Formula: | C9H18O2·(NH3) |
Canonical SMILES: | CCCCCCCCC(=O)[O-].[NH4+] |
InChI: | InChI=1S/C9H18O2.H3N/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)1H3 |
InChI Key: | KLIDOSBTXDALBI-UHFFFAOYSA-N |
Complexity: | 94.2 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 175.157228913 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 175.157228913 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 41.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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