| CAS Number | 926185-85-5 |
| Catalog Number | AG019UG5 |
| Chemical Name | {4-[(3,5-Dimethylpiperidin-1-yl)methyl]phenyl}methanamine |
| IUPAC Name | [4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methanamine |
| InChI | InChI=1S/C15H24N2/c1-12-7-13(2)10-17(9-12)11-15-5-3-14(8-16)4-6-15/h3-6,12-13H,7-11,16H2,1-2H3 |
| InChI Key | YMVFPSOLZLYHIV-UHFFFAOYSA-N |
| MDL Number | MFCD08442766 |
| Molecular Formula | C15H24N2 |
| Molecular Weight | 232.3645 |
| SMILES | CC1CN(CC2=CC=C(CN)C=C2)CC(C)C1 |
| Synonyms | {4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl}methanamine,
926185-85-5,
1-(4-[(3,5-Dimethylpiperidin-1-yl)methyl]phenyl)methanamine,
(4-((3,5-dimethylpiperidin-1-yl)methyl)phenyl)methanamine,
AC1Q2QM8,
CTK7E4442,
AKOS000125594,
AKOS016899554,
MCULE-9092115122,
NE13824,
EN300-41564,
|
| Complexity | 211 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.371g/mol |
| Monoisotopic Mass | 232.194g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
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Certificate of Analysis
Lot Number