| CAS Number | 56669-84-2 |
| Catalog Number | AG01BU71(AGN-PC-02SSV1) |
| Chemical Name | 3-(Chloromethyl)-1-methylpyrrolidine hydrochloride |
| IUPAC Name | 3-(chloromethyl)-1-methylpyrrolidine;hydrochloride |
| InChI | InChI=1S/C6H12ClN.ClH/c1-8-3-2-6(4-7)5-8;/h6H,2-5H2,1H3;1H |
| InChI Key | FMXGHRPHPIBFHD-UHFFFAOYSA-N |
| MDL Number | MFCD20441425 |
| Molecular Formula | C6H13Cl2N |
| Molecular Weight | 170.0801 |
| SMILES | Cl.CN1CC(CCl)CC1 |
| Synonyms | 3-(chloromethyl)-1-methylpyrrolidine hydrochloride,
56669-84-2,
SCHEMBL11540251,
5705AJ,
AKOS027256974,
3-(Chloromethyl)-1-methylpyrrolidine HCl,
AM100961,
SY026835,
MFCD20441425 (95%),
C6H12ClN.HCl,
58689-43-3,
|
| Complexity | 74.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.042505g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.08g/mol |
| Monoisotopic Mass | 169.042505g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 3.2Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number