| CAS Number | 1956364-14-9 |
| Catalog Number | AG01EJSZ |
| Chemical Name | 1-(Pyrrolidin-3-Yl)Ethanone Hydrochloride |
| IUPAC Name | 1-pyrrolidin-3-ylethanone;hydrochloride |
| InChI | InChI=1S/C6H11NO.ClH/c1-5(8)6-2-3-7-4-6;/h6-7H,2-4H2,1H3;1H |
| InChI Key | BJIQZEPWXLMFFP-UHFFFAOYSA-N |
| MDL Number | MFCD18381078 |
| Molecular Formula | C6H12ClNO |
| Molecular Weight | 149.6186 |
| SMILES | Cl.N1CC(CC1)C(C)=O |
| Synonyms | 1-(Pyrrolidin-3-yl)ethanone hydrochloride,
Pyrrolidin-3-yl-ethanone hydrochloride,
1956364-14-9,
J-503627,
C6H11NO.ClH,
3-Acetyl-pyrrolidine hydrochloride,
MFCD18381078,
AKOS025290472,
RP01632,
1-(PYRROLIDIN-3-YL)ETHANONE HCL,
DB-077064,
Y4441,
1-(pyrrolidin-3-yl)ethan-1-one hydrochloride,
W-3145,
876505-26-9,
|
| Complexity | 101 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 149.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 149.618g/mol |
| Monoisotopic Mass | 149.061g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number