| CAS Number | 151858-52-5 |
| Catalog Number | AG00B3YA |
| Chemical Name | Methyl 2-amino-2,3-dimethylbutanoate |
| IUPAC Name | methyl 2-amino-2,3-dimethylbutanoate |
| InChI | InChI=1S/C7H15NO2/c1-5(2)7(3,8)6(9)10-4/h5H,8H2,1-4H3 |
| InChI Key | OQQLWOQWKDIFEB-UHFFFAOYSA-N |
| MDL Number | MFCD16769895 |
| Molecular Formula | C7H15NO2 |
| Molecular Weight | 145.1995 |
| SMILES | COC(C(C(C)C)(N)C)=O |
| Synonyms | methyl 2-amino-2,3-dimethylbutanoate,
151858-52-5,
SCHEMBL4511104,
OQQLWOQWKDIFEB-UHFFFAOYSA-N,
methyl 2-amino-2,3-dimethylbutyrate,
AKOS011776154,
methyl 2-amino-2,3-dimethyl-butyrate,
3-trimethylaminopropionic acid methylester,
2,3-Dimethyl-2-aminobutanoic acid methyl ester,
Isovaline, 3-methyl-, methyl ester (9CI),
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| Complexity | 134 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 145.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 145.202g/mol |
| Monoisotopic Mass | 145.11g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number