| CAS Number | 25566-00-1 |
| Catalog Number | AG00CD9O |
| Chemical Name | (3-Hydroxyazetidin-1-yl)(phenyl)methanone |
| IUPAC Name | (3-hydroxyazetidin-1-yl)-phenylmethanone |
| InChI | InChI=1S/C10H11NO2/c12-9-6-11(7-9)10(13)8-4-2-1-3-5-8/h1-5,9,12H,6-7H2 |
| InChI Key | MQPNDHHRMVRTCE-UHFFFAOYSA-N |
| MDL Number | MFCD14583059 |
| Molecular Formula | C10H11NO2 |
| Molecular Weight | 177.1998 |
| SMILES | OC1CN(C(C2=CC=CC=C2)=O)C1 |
| Synonyms | 1-benzoylazetidin-3-ol,
25566-00-1,
Methanone, (3-hydroxy-1-azetidinyl)phenyl-,
(3-hydroxy-1-azetidinyl)phenylMethanone,
(3-hydroxyazetidin-1-yl)(phenyl)methanone,
N-benzoyl-3-azetidinol,
SCHEMBL3110491,
1-(phenylcarbonyl)azetidin-3-ol,
MQPNDHHRMVRTCE-UHFFFAOYSA-N,
ZINC60097337,
AKOS012407956,
FT-0702262,
|
| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.203g/mol |
| Monoisotopic Mass | 177.079g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
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Certificate of Analysis
Lot Number