| CAS Number | 49755-46-6 |
| Catalog Number | AG00E3LT(AGN-PC-0S4N6N) |
| Chemical Name | Pyrrolidine-1-carboxamidine hydrochloride |
| IUPAC Name | pyrrolidine-1-carboximidamide;hydrochloride |
| InChI | InChI=1S/C5H11N3.ClH/c6-5(7)8-3-1-2-4-8;/h1-4H2,(H3,6,7);1H |
| InChI Key | STXJBYRHIUKYKY-UHFFFAOYSA-N |
| MDL Number | MFCD25963774 |
| Molecular Formula | C5H12ClN3 |
| Molecular Weight | 149.6219 |
| SMILES | Cl.NC(N1CCCC1)=N |
| Synonyms | pyrrolidine-1-carboxamidine hydrochloride,
49755-46-6,
pyrrolidine-1-carboximidamide hydrochloride,
SCHEMBL3192296,
STXJBYRHIUKYKY-UHFFFAOYSA-N,
KS-000023ZC,
MFCD25963774,
AKOS025141977,
CS-10205,
OR300903,
1-PYRROLIDINECARBOXIMIDAMIDE, MONOHYDROCHLORIDE,
|
| Complexity | 93.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 149.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 149.622g/mol |
| Monoisotopic Mass | 149.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 53.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number