| CAS Number | 923233-40-3 |
| Catalog Number | AG019LBJ |
| Chemical Name | 1-(4-[(4-Methylpiperidin-1-yl)methyl]phenyl)methanamine |
| IUPAC Name | [4-[(4-methylpiperidin-1-yl)methyl]phenyl]methanamine |
| InChI | InChI=1S/C14H22N2/c1-12-6-8-16(9-7-12)11-14-4-2-13(10-15)3-5-14/h2-5,12H,6-11,15H2,1H3 |
| InChI Key | KIZSJLCCKVRTQU-UHFFFAOYSA-N |
| MDL Number | MFCD08444581 |
| Molecular Formula | C14H22N2 |
| Molecular Weight | 218.3379 |
| SMILES | CC1CCN(CC2=CC=C(CN)C=C2)CC1 |
| Synonyms | {4-[(4-methylpiperidin-1-yl)methyl]phenyl}methanamine,
923233-40-3,
1-[4-[(4-Methylpiperidin-1-yl)methyl]phenyl]methanamine,
1-{4-[(4-methylpiperidin-1-yl)methyl]phenyl}methanamine,
(4-((4-methylpiperidin-1-yl)methyl)phenyl)methanamine,
AC1Q2R9K,
CTK7E4444,
ZINC20281587,
AKOS000131170,
MCULE-3980623220,
BB 0263043,
EN300-30711,
Z228584528,
1-(4-[(4-methylpiperidin-1-yl)methyl]phenyl)methanamine, AldrichCPR,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.178g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.344g/mol |
| Monoisotopic Mass | 218.178g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number