Ethyl 2-amino-3-oxobutanoate hydrochloride - CAS 20207-16-3
Catalog: |
BB065893 |
Product Name: |
Ethyl 2-amino-3-oxobutanoate hydrochloride |
CAS: |
20207-16-3 |
Synonyms: |
ethyl 2-amino-3-oxobutanoate hydrochloride; Ethyl 2-amino-3-oxobutanoate, HCl; ethyl 2-amino-3-oxobutanoate; hydrochloride; Butanoic acid, 2-amino-3-oxo-, ethyl ester, hydrochloride; ETHYL 2-AMINO-3-OXOBUTANOATE HCL |
IUPAC Name: | ethyl 2-amino-3-oxobutanoatehydrochloride |
Description: | Ethyl 2-amino-3-oxobutanoate, HCl |
Molecular Weight: | 181.62 |
Molecular Formula: | C6H12ClNO3 |
Canonical SMILES: | CCOC(=O)C(C(=O)C)N.Cl |
InChI: | InChI=1S/C6H11NO3.ClH/c1-3-10-6(9)5(7)4(2)8/h5H,3,7H2,1-2H31H |
InChI Key: | BGJIQVZAHKXUFG-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 144 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 181.0505709 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 181.0505709 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 69.4Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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