4-Amino-3-methylbutanoic Acid Hydrochloride - CAS 62306-84-7
Catalog: |
BB054960 |
Product Name: |
4-Amino-3-methylbutanoic Acid Hydrochloride |
CAS: |
62306-84-7 |
Synonyms: |
4-amino-3-methylbutanoic acid hydrochloride; 4-amino-3-methylbutanoic acid; hydrochloride; rac 4-Amino-3-methyl-butyric acid x HCl; 4-Amino-3-methyl-butyric acid HCl |
IUPAC Name: | 4-amino-3-methylbutanoic acidhydrochloride |
Molecular Weight: | 117.15 + 36.46 |
Molecular Formula: | C5H11NO2·HCl |
Canonical SMILES: | CC(CC(=O)O)CN.Cl |
InChI: | InChI=1S/C5H11NO2.ClH/c1-4(3-6)2-5(7)8/h4H,2-3,6H2,1H3,(H,7,8)1H |
InChI Key: | SKNMCRZGRMXQAW-UHFFFAOYSA-N |
Complexity: | 82.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 153.0556563 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.0556563 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 63.3Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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