| CAS Number | 661470-63-9 |
| Catalog Number | AG00FD52(AGN-PC-05BI7E) |
| Chemical Name | 3-(2-Methylphenyl)piperidine |
| IUPAC Name | 3-(2-methylphenyl)piperidine |
| InChI | InChI=1S/C12H17N/c1-10-5-2-3-7-12(10)11-6-4-8-13-9-11/h2-3,5,7,11,13H,4,6,8-9H2,1H3 |
| InChI Key | KQSRZADCJRPBDF-UHFFFAOYSA-N |
| MDL Number | MFCD09802306 |
| Molecular Formula | C12H17N |
| Molecular Weight | 175.2701 |
| SMILES | C1(C=CC=CC=1C)C1CCCNC1 |
| Synonyms | 3-(2-methylphenyl)piperidine,
661470-63-9,
3-O-Tolyl-Piperidine,
3-(o-Tolyl)piperidine,
AC1Q2EQH,
SCHEMBL3644759,
DTXSID30451728,
KQSRZADCJRPBDF-UHFFFAOYSA-N,
Piperidine, 3-(2-methylphenyl)-,
ALBB-028867,
AKOS005264730,
DB-073716,
FT-0742302,
Y-5519,
3-o-tolylpiperidine,
3- PIPERIDINE,
CID11009230,
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| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.275g/mol |
| Monoisotopic Mass | 175.136g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number