2-Carbamoylpiperidine-4-carboxylic Acid Hydrochloride - CAS 1394040-09-5
Catalog: |
BB073080 |
Product Name: |
2-Carbamoylpiperidine-4-carboxylic Acid Hydrochloride |
CAS: |
1394040-09-5 |
Synonyms: |
2-carbamoylpiperidine-4-carboxylic acid hydrochloride; 2-carbamoylpiperidine-4-carboxylic acid; hydrochloride; 2-carbamoylpiperidine-4-carboxylicacidhydrochloride |
IUPAC Name: | 2-carbamoylpiperidine-4-carboxylic acidhydrochloride |
Molecular Weight: | 172.18 + (36.46) |
Molecular Formula: | C7H12N2O3·HCl |
Canonical SMILES: | C1CNC(CC1C(=O)O)C(=O)N.Cl |
InChI: | InChI=1S/C7H12N2O3.ClH/c8-6(10)5-3-4(7(11)12)1-2-9-5/h4-5,9H,1-3H2,(H2,8,10)(H,11,12)1H |
InChI Key: | UECLMVQBBSPOFH-UHFFFAOYSA-N |
Complexity: | 205 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.06147 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.06147 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 92.4Ų |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
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