| CAS Number | 78342-50-4 |
| Catalog Number | AG00ICXV(AGN-PC-0WOJAO) |
| Chemical Name | (R)-2-Amino-4-pentynoic acid, methyl ester |
| IUPAC Name | methyl (2R)-2-aminopent-4-ynoate |
| InChI | InChI=1S/C6H9NO2/c1-3-4-5(7)6(8)9-2/h1,5H,4,7H2,2H3/t5-/m1/s1 |
| InChI Key | GHQXMDDXHKPECL-RXMQYKEDSA-N |
| MDL Number | MFCD18252702 |
| Molecular Formula | C6H9NO2 |
| Molecular Weight | 127.1412 |
| SMILES | COC([C@@H](CC#C)N)=O |
| Synonyms | (R)-2-Amino-4-pentynoic acid, methyl ester,
78342-50-4,
(R)-methyl 2-aminopent-4-ynoate,
SCHEMBL4343910,
GHQXMDDXHKPECL-RXMQYKEDSA-N,
ZINC13356440,
METHYL (2R)-2-AMINOPENT-4-YNOATE,
(R)-2-Amino-4-pentyneoic acid methyl ester,
methyl D-propargylglycinate,
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| Complexity | 144 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 127.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 127.143g/mol |
| Monoisotopic Mass | 127.063g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number