| CAS Number | 933723-96-7 |
| Catalog Number | AG01ARF4 |
| Chemical Name | (1-(4-Methoxyphenyl)pyrrolidin-3-yl)methanamine |
| IUPAC Name | [1-(4-methoxyphenyl)pyrrolidin-3-yl]methanamine |
| InChI | InChI=1S/C12H18N2O/c1-15-12-4-2-11(3-5-12)14-7-6-10(8-13)9-14/h2-5,10H,6-9,13H2,1H3 |
| InChI Key | NKHWOJQUGQNVGN-UHFFFAOYSA-N |
| MDL Number | MFCD09935615 |
| Molecular Formula | C12H18N2O |
| Molecular Weight | 206.2841 |
| SMILES | COC1=CC=C(N2CC(CN)CC2)C=C1 |
| Synonyms | (1-(4-METHOXYPHENYL)PYRROLIDIN-3-YL)METHANAMINE,
933723-96-7,
[1-(4-methoxyphenyl)pyrrolidin-3-yl]methanamine,
MFCD09935615,
AKOS000177866,
AKOS016050444,
AS-38453,
[1-(4-Methoxyphenyl)-3-pyrrolidinyl]methanamine,
F2147-0267,
|
| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.289g/mol |
| Monoisotopic Mass | 206.142g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
Lot Number