| CAS Number | 1016757-84-8 |
| Catalog Number | AG019MAP(AGN-PC-0WO5X0) |
| Chemical Name | 1-[(3-Aminophenyl)methyl]piperidin-4-ol |
| IUPAC Name | 1-[(3-aminophenyl)methyl]piperidin-4-ol |
| InChI | InChI=1S/C12H18N2O/c13-11-3-1-2-10(8-11)9-14-6-4-12(15)5-7-14/h1-3,8,12,15H,4-7,9,13H2 |
| InChI Key | URVMBDCFIVHKBG-UHFFFAOYSA-N |
| MDL Number | MFCD09813329 |
| Molecular Formula | C12H18N2O |
| Molecular Weight | 206.2841 |
| SMILES | NC1=CC(CN2CCC(O)CC2)=CC=C1 |
| Synonyms | 1-(3-aminobenzyl)piperidin-4-ol,
1-[(3-aminophenyl)methyl]piperidin-4-ol,
1016757-84-8,
AC1Q51NH,
SCHEMBL3961183,
CTK8A0551,
ZINC12480784,
AKOS000163046,
MCULE-5261013255,
NE50551,
FT-0726868,
1-(3-aminobenzyl)piperidin-4-ol, AldrichCPR,
EN300-35610,
|
| 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 | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.289g/mol |
| Monoisotopic Mass | 206.142g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 49.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
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Certificate of Analysis
Lot Number