| CAS Number | 1094233-84-7 |
| Catalog Number | AG01A8CT |
| Chemical Name | [1-(4-Aminobenzoyl)piperidin-4-yl]methanol |
| IUPAC Name | (4-aminophenyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone |
| InChI | InChI=1S/C13H18N2O2/c14-12-3-1-11(2-4-12)13(17)15-7-5-10(9-16)6-8-15/h1-4,10,16H,5-9,14H2 |
| InChI Key | SNYDJFPGPSHXCW-UHFFFAOYSA-N |
| MDL Number | MFCD11132986 |
| Molecular Formula | C13H18N2O2 |
| Molecular Weight | 234.2942 |
| SMILES | NC1=CC=C(C(N2CCC(CO)CC2)=O)C=C1 |
| Synonyms | [1-(4-aminobenzoyl)piperidin-4-yl]methanol,
1094233-84-7,
{1-[(4-aminophenyl)carbonyl]piperidin-4-yl}methanol,
AC1Q51SV,
SCHEMBL12460079,
CTK8A3103,
ZINC36720911,
AKOS009290714,
MCULE-4231936233,
NE45685,
EN300-61338,
Z1262250871,
(1-[(4-aminophenyl)carbonyl]piperidin-4-yl)methanol,
|
| Complexity | 254 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.299g/mol |
| Monoisotopic Mass | 234.137g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 66.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
Lot Number