| CAS Number | 1197625-41-4 |
| Catalog Number | AG00HF46(AGN-PC-0WG3RD) |
| Chemical Name | 1-[(2-Aminophenyl)methyl]pyrrolidin-2-one hydrochloride |
| IUPAC Name | 1-[(2-aminophenyl)methyl]pyrrolidin-2-one;hydrochloride |
| InChI | InChI=1S/C11H14N2O.ClH/c12-10-5-2-1-4-9(10)8-13-7-3-6-11(13)14;/h1-2,4-5H,3,6-8,12H2;1H |
| InChI Key | FGIMXDLSZYGWLI-UHFFFAOYSA-N |
| MDL Number | MFCD12913190 |
| Molecular Formula | C11H15ClN2O |
| Molecular Weight | 226.7026 |
| SMILES | Cl.NC1=C(CN2C(=O)CCC2)C=CC=C1 |
| Synonyms | 1-[(2-aminophenyl)methyl]pyrrolidin-2-one hydrochloride,
1197625-41-4,
1-(2-Aminobenzyl)pyrrolidin-2-one hydrochloride,
1-[(2-Aminophenyl)methyl]pyrrolidin-2-one HCl,
AC1Q3CWS,
CTK7H4131,
MFCD12913190,
AKOS026670870,
MCULE-3798194057,
NE58574,
CS-0039026,
EN300-52958,
1-[(2-aminophenyl)methyl]pyrrolidin-2-one;hydrochloride,
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| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.087g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.704g/mol |
| Monoisotopic Mass | 226.087g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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