| CAS Number | 59147-44-3 |
| Catalog Number | AG019M0X |
| Chemical Name | 3-Chloro-1-(piperidin-1-yl)propan-1-one |
| IUPAC Name | 3-chloro-1-piperidin-1-ylpropan-1-one |
| InChI | InChI=1S/C8H14ClNO/c9-5-4-8(11)10-6-2-1-3-7-10/h1-7H2 |
| InChI Key | MBALNTIFBNPOTI-UHFFFAOYSA-N |
| MDL Number | MFCD02286128 |
| Molecular Formula | C8H14ClNO |
| Molecular Weight | 175.6559 |
| SMILES | ClCCC(=O)N1CCCCC1 |
| Synonyms | 3-chloro-1-(piperidin-1-yl)propan-1-one,
1-(3-chloropropanoyl)piperidine,
59147-44-3,
AC1MUV6N,
AC1Q3UEL,
SCHEMBL11028192,
CTK6H7251,
ZINC5725576,
AKOS000143911,
NE49546,
3-chloro-1-piperidin-1-ylpropan-1-one,
EN300-33658,
CID3647118,
3-chloro-1-(1-piperidyl)propan-1-one,
1-propanone, 3-chloro-1-(1-piperidinyl)-,
|
| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.656g/mol |
| Monoisotopic Mass | 175.076g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number