| CAS Number | 1315368-94-5 |
| Catalog Number | AG01AJ80(AGN-PC-0WOST6) |
| Chemical Name | 3-(aminomethyl)-3-phenylcyclobutan-1-one hydrochloride |
| IUPAC Name | 3-(aminomethyl)-3-phenylcyclobutan-1-one;hydrochloride |
| InChI | InChI=1S/C11H13NO.ClH/c12-8-11(6-10(13)7-11)9-4-2-1-3-5-9;/h1-5H,6-8,12H2;1H |
| InChI Key | AALDBCDELOCQSS-UHFFFAOYSA-N |
| MDL Number | MFCD19382134 |
| Molecular Formula | C11H14ClNO |
| Molecular Weight | 211.6880 |
| SMILES | Cl.NCC1(C2=CC=CC=C2)CC(=O)C1 |
| Synonyms | 3-(aminomethyl)-3-phenylcyclobutan-1-one hydrochloride,
EN300-79998,
1315368-94-5,
AKOS026742692,
MCULE-4445076219,
Z1696861483,
|
| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.689g/mol |
| Monoisotopic Mass | 211.076g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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