| CAS Number | 824-50-0 |
| Catalog Number | AG00G7K0(AGN-PC-0WBOVC) |
| Chemical Name | 2-(2-Methylpiperidin-1-yl)acetonitrile |
| IUPAC Name | 2-(2-methylpiperidin-1-yl)acetonitrile |
| InChI | InChI=1S/C8H14N2/c1-8-4-2-3-6-10(8)7-5-9/h8H,2-4,6-7H2,1H3 |
| InChI Key | ACOLJMMCKXMANR-UHFFFAOYSA-N |
| MDL Number | MFCD09906881 |
| Molecular Formula | C8H14N2 |
| Molecular Weight | 138.2102 |
| SMILES | CC1N(CC#N)CCCC1 |
| Synonyms | (2-methylpiperidin-1-yl)acetonitrile,
824-50-0,
2-(2-methylpiperidin-1-yl)acetonitrile,
AC1Q2R39,
CTK7D0538,
ALBB-004602,
0186AF,
MFCD09906881,
STK503248,
AKOS000197338,
AKOS016345383,
MCULE-2122433566,
NE14601,
TR-058333,
EN300-43411,
C8H14N2,
|
| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 138.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 138.214g/mol |
| Monoisotopic Mass | 138.116g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 27A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number