| CAS Number | 309978-00-5 |
| Catalog Number | AG0031VN(AGN-PC-0R6EJ2) |
| Chemical Name | methyl 2-methylazetidine-2-carboxylate hydrochloride |
| IUPAC Name | methyl 2-methylazetidine-2-carboxylate;hydrochloride |
| InChI | InChI=1S/C6H11NO2.ClH/c1-6(3-4-7-6)5(8)9-2;/h7H,3-4H2,1-2H3;1H |
| InChI Key | HKRDVTDOFOMXDY-UHFFFAOYSA-N |
| MDL Number | MFCD18812894 |
| Molecular Formula | C6H12ClNO2 |
| Molecular Weight | 165.6180 |
| SMILES | Cl.COC(C1(NCC1)C)=O |
| Synonyms | Methyl 2-methylazetidine-2-carboxylate hydrochloride,
309978-00-5,
SCHEMBL11294917,
MFCD18812894,
SB15614,
CS-0056591,
2-Azetidinecarboxylic acid, 2-methyl-, methyl ester, hydrochloride (1:1),
2-azetidinecarboxylic acid,2-methyl-,methyl ester hydrochloride,
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| Complexity | 135 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.617g/mol |
| Monoisotopic Mass | 165.056g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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