| CAS Number | 885268-85-9 |
| Catalog Number | AG00474L(AGN-PC-0VM4Y0) |
| Chemical Name | (3-Amino-1-benzylpiperidin-3-yl)methanol |
| IUPAC Name | (3-amino-1-benzylpiperidin-3-yl)methanol |
| InChI | InChI=1S/C13H20N2O/c14-13(11-16)7-4-8-15(10-13)9-12-5-2-1-3-6-12/h1-3,5-6,16H,4,7-11,14H2 |
| InChI Key | QEWVFFOOCJNJEO-UHFFFAOYSA-N |
| MDL Number | MFCD08234493 |
| Molecular Formula | C13H20N2O |
| Molecular Weight | 220.3107 |
| SMILES | NC1(CN(CC2=CC=CC=C2)CCC1)CO |
| Synonyms | (3-Amino-1-benzylpiperidin-3-yl)methanol,
885268-85-9,
3-Piperidinemethanol,3-amino-1-(phenylmethyl)-,
[3-amino-1-(phenylmethyl)-3-piperidinyl]methanol,
CTK5G0107,
DTXSID90670453,
AKOS008142750,
MCULE-3452748247,
RP27269,
DB-005504,
TC-061655,
FT-0080994,
FT-0651010,
EN300-76047,
A842649,
[3-azanyl-1-(phenylmethyl)piperidin-3-yl]methanol,
J-501116,
Z1267882055,
RW1349,
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| Complexity | 216 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.316g/mol |
| Monoisotopic Mass | 220.158g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number