| CAS Number | 42746-87-2 |
| Catalog Number | AG00CMVC(AGN-PC-0WB6SE) |
| Chemical Name | 2-[(dimethylamino)methyl]cyclopentanone hydrochloride |
| IUPAC Name | 2-[(dimethylamino)methyl]cyclopentan-1-one;hydrochloride |
| InChI | InChI=1S/C8H15NO.ClH/c1-9(2)6-7-4-3-5-8(7)10;/h7H,3-6H2,1-2H3;1H |
| InChI Key | UYEYOIARTNJQBB-UHFFFAOYSA-N |
| MDL Number | MFCD00225117 |
| Molecular Formula | C8H16ClNO |
| Molecular Weight | 177.6717 |
| NSC Number | 621888 |
| SMILES | C1(CCCC1=O)CN(C)C.Cl |
| Synonyms | 42746-87-2,
2-[(dimethylamino)methyl]cyclopentan-1-one hydrochloride,
NSC621888,
2-((Dimethylamino)methyl)cyclopentanone hydrochloride,
2-[(Dimethylamino)methyl]cyclopentanone hydrochloride,
AC1L7FYL,
CHEMBL1999353,
2-dimethylaminomethyl-cyclopentanone,
MFCD00225117,
AKOS024322539,
MCULE-5987666640,
NE11403,
NSC-621888,
2-dimethylaminomethyl-cyclopentanone hydrochloride,
2-(dimethylaminomethyl)cyclopentan-1-one hydrochloride,
Z1272096659,
Cyclopentanone, hydrochloride,
CID360084,
2-[(dimethylamino)methyl]cyclopentan-1-one,hydrochloride,
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| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.672g/mol |
| Monoisotopic Mass | 177.092g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number