| CAS Number | 1820569-23-0 |
| Catalog Number | AG01X4P2 |
| Chemical Name | Pyrrolidine, 3,4-dimethyl-, hydrochloride (1:1), (3S,4S)- |
| IUPAC Name | (3S,4S)-3,4-dimethylpyrrolidine;hydrochloride |
| InChI | InChI=1S/C6H13N.ClH/c1-5-3-7-4-6(5)2;/h5-7H,3-4H2,1-2H3;1H/t5-,6-;/m1./s1 |
| InChI Key | NENQMVAHTAYJTP-KGZKBUQUSA-N |
| Molecular Formula | C6H14ClN |
| Molecular Weight | 135.6351 |
| SMILES | C[C@@H]1CNC[C@H]1C.Cl |
| Synonyms | 1638221-50-7,
cis-3,4-Dimethylpyrrolidine hydrochloride,
trans-3,4-Dimethylpyrrolidine hydrochloride,
235094-36-7,
MFCD28119219,
AKOS030253966,
trans-3,4-dimethylpyrrolidine hyrdochloride,
|
| Complexity | 53.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 135.081g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 135.635g/mol |
| Monoisotopic Mass | 135.081g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number