| CAS Number | 87517-47-3 |
| Catalog Number | AG004HB4(AGN-PC-00LFIY) |
| Chemical Name | Butanoic acid, 4-azido-, methyl ester |
| IUPAC Name | methyl 4-azidobutanoate |
| InChI | InChI=1S/C5H9N3O2/c1-10-5(9)3-2-4-7-8-6/h2-4H2,1H3 |
| InChI Key | DPCLJBYTRUAAHH-UHFFFAOYSA-N |
| MDL Number | MFCD14652831 |
| Molecular Formula | C5H9N3O2 |
| Molecular Weight | 143.1439 |
| SMILES | [N-]=[N+]=NCCCC(=O)OC |
| Synonyms | methyl 4-azidobutanoate,
87517-47-3,
4-Azidobutyric acid methyl ester,
Methyl 4-azidobutyrate,
Butanoic acid, 4-azido-, methyl ester,
SCHEMBL15498954,
CTK3C3448,
KS-00002BEP,
DTXSID50527176,
4-azido-butyric acid methyl ester,
DPCLJBYTRUAAHH-UHFFFAOYSA-N,
ZINC39420049,
AKOS010631530,
NE39178,
SS-4851,
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| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 143.146g/mol |
| Monoisotopic Mass | 143.069g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 40.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number