| CAS Number | 944276-44-2 |
| Catalog Number | AG00II5J(AGN-PC-014RTD) |
| Chemical Name | 3-(Hydroxymethyl)-1-methylpiperidin-2-one |
| IUPAC Name | 3-(hydroxymethyl)-1-methylpiperidin-2-one |
| InChI | InChI=1S/C7H13NO2/c1-8-4-2-3-6(5-9)7(8)10/h6,9H,2-5H2,1H3 |
| InChI Key | YWINIVAYENZCJR-UHFFFAOYSA-N |
| MDL Number | MFCD13178879 |
| Molecular Formula | C7H13NO2 |
| Molecular Weight | 143.1836 |
| SMILES | CN1C(=O)C(CO)CCC1 |
| Synonyms | 3-(Hydroxymethyl)-1-methylpiperidin-2-one,
944276-44-2,
3-(hydroxymethyl)-1-methyl-2-Piperidinone,
SCHEMBL16609893,
DTXSID20587328,
6143AC,
MFCD13178879,
AKOS016009046,
AS-47581,
DB-079879,
FT-0765934,
Z2235810267,
C7H13NO2,
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| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 143.186g/mol |
| Monoisotopic Mass | 143.095g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number