| CAS Number | 1208744-99-3 |
| Catalog Number | AG019X2U(AGN-PC-0WO58A) |
| Chemical Name | (1,5-dimethyl-1H-pyrrol-2-yl)methanamine hydrochloride |
| IUPAC Name | (1,5-dimethylpyrrol-2-yl)methanamine;hydrochloride |
| InChI | InChI=1S/C7H12N2.ClH/c1-6-3-4-7(5-8)9(6)2;/h3-4H,5,8H2,1-2H3;1H |
| InChI Key | WKQBCJINNOJFIA-UHFFFAOYSA-N |
| MDL Number | MFCD13195956 |
| Molecular Formula | C7H13ClN2 |
| Molecular Weight | 160.6445 |
| SMILES | Cl.CC1N(C)C(CN)=CC=1 |
| Synonyms | (1,5-dimethyl-1H-pyrrol-2-yl)methanamine hydrochloride,
1208744-99-3,
AC1Q3BMM,
CTK6I1600,
AKOS026727801,
MCULE-1979344860,
NE59787,
EN300-53909,
|
| Complexity | 92.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 160.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 160.645g/mol |
| Monoisotopic Mass | 160.077g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 31A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number