| CAS Number | 17382-09-1 |
| Catalog Number | AG019RHG(AGN-PC-0WOFKZ) |
| Chemical Name | 1-Amino-3-phenylcyclobutane-1-carboxylic acid |
| IUPAC Name | 1-amino-3-phenylcyclobutane-1-carboxylic acid |
| InChI | InChI=1S/C11H13NO2/c12-11(10(13)14)6-9(7-11)8-4-2-1-3-5-8/h1-5,9H,6-7,12H2,(H,13,14) |
| InChI Key | UDEFVMDARGSLMK-UHFFFAOYSA-N |
| MDL Number | MFCD17480495 |
| Molecular Formula | C11H13NO2 |
| Molecular Weight | 191.2264 |
| SMILES | NC1(C(O)=O)CC(C2=CC=CC=C2)C1 |
| Synonyms | 1-amino-3-phenylcyclobutane-1-carboxylic acid,
17382-09-1,
AC1Q50FN,
ZINC57219020,
AKOS023845542,
NE54363,
EN300-89725,
Z1139751314,
|
| Complexity | 227 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.23g/mol |
| Monoisotopic Mass | 191.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number