| CAS Number | 934665-46-0 |
| Catalog Number | AG00IHMU(AGN-PC-0WCKDF) |
| Chemical Name | tert-butyl 3-ethylideneazetidine-1-carboxylate |
| IUPAC Name | tert-butyl 3-ethylideneazetidine-1-carboxylate |
| InChI | InChI=1S/C10H17NO2/c1-5-8-6-11(7-8)9(12)13-10(2,3)4/h5H,6-7H2,1-4H3 |
| InChI Key | BBIQBESQCNUEAJ-UHFFFAOYSA-N |
| MDL Number | MFCD11976451 |
| Molecular Formula | C10H17NO2 |
| Molecular Weight | 183.2475 |
| SMILES | O=C(N1CC(C1)=CC)OC(C)(C)C |
| Synonyms | tert-Butyl 3-ethylideneazetidine-1-carboxylate,
934665-46-0,
SCHEMBL1488405,
DTXSID40680269,
BBIQBESQCNUEAJ-UHFFFAOYSA-N,
FCH898353,
MFCD12031238,
ZINC42750145,
AKOS006316677,
PB28375,
KS-000004U0,
AK171112,
AS-34100,
CS-0048300,
1,1-dimethylethyl 3-ethylideneazetidine-1-carboxylate,
1-Azetidinecarboxylic acid, 3-ethylidene-, 1,1-dimethylethyl ester,
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| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.251g/mol |
| Monoisotopic Mass | 183.126g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number