| CAS Number | 1170201-85-0 |
| Catalog Number | AG00J167(AGN-PC-0WO11I) |
| Chemical Name | 1-[4-(aminomethyl)phenyl]-2-pyrrolidinone hydrochloride |
| IUPAC Name | 1-[4-(aminomethyl)phenyl]pyrrolidin-2-one;hydrochloride |
| InChI | InChI=1S/C11H14N2O.ClH/c12-8-9-3-5-10(6-4-9)13-7-1-2-11(13)14;/h3-6H,1-2,7-8,12H2;1H |
| InChI Key | IADIDCMKPSLFBD-UHFFFAOYSA-N |
| MDL Number | MFCD06799747 |
| Molecular Formula | C11H15ClN2O |
| Molecular Weight | 226.7026 |
| SMILES | N1(CCCC1=O)C1C=CC(=CC=1)CN.Cl |
| Synonyms | 1-[4-(aminomethyl)phenyl]pyrrolidin-2-one hydrochloride,
1170201-85-0,
1-(4-Aminomethyl-phenyl)-pyrrolidin-2-one hydrochloride,
1-[4-(aminomethyl)phenyl]-2-pyrrolidinone hydrochloride,
1-(4-Aminomethyl-phenyl)-pyrrolidin-2-one,
AC1Q3D7B,
CTK7E4532,
MFCD06799747,
AKOS015847664,
NE13445,
TR-041349,
EN300-31343,
1-(4-Aminomethylphenyl)-pyrrolidin-2-one hydrochloride,
Z335451510,
1-(4-aminomethyl-phenyl)-pyrrolidin-2-one hydrochloride, AldrichCPR,
1-[4-(aminomethyl)phenyl]pyrrolidin-2-one,
36151-42-5,
|
| Complexity | 209 |
| 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
Lot Number