| CAS Number | 438487-47-9 |
| Catalog Number | AG01C77Q |
| Chemical Name | Phenyl 3-hydroxyazetidine-1-carboxylate |
| IUPAC Name | phenyl 3-hydroxyazetidine-1-carboxylate |
| InChI | InChI=1S/C10H11NO3/c12-8-6-11(7-8)10(13)14-9-4-2-1-3-5-9/h1-5,8,12H,6-7H2 |
| InChI Key | YEJDNGGGLVFJJX-UHFFFAOYSA-N |
| MDL Number | MFCD14635896 |
| Molecular Formula | C10H11NO3 |
| Molecular Weight | 193.1992 |
| SMILES | OC1CN(C(OC2=CC=CC=C2)=O)C1 |
| Synonyms | phenyl 3-hydroxyazetidine-1-carboxylate,
438487-47-9,
ZINC62809455,
AKOS012406443,
3-Hydroxyazetidine-1-carboxylic acid phenyl ester,
|
| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.202g/mol |
| Monoisotopic Mass | 193.074g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 49.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
Lot Number