| CAS Number | 646-03-7 |
| Catalog Number | AG006T5M(AGN-PC-0TD7GZ) |
| Chemical Name | 3-Aminopropanenitrile hydrochloride |
| IUPAC Name | 3-aminopropanenitrile;hydrochloride |
| InChI | InChI=1S/C3H6N2.ClH/c4-2-1-3-5;/h1-2,4H2;1H |
| InChI Key | SOWHACJNMKTTRC-UHFFFAOYSA-N |
| MDL Number | MFCD22741514 |
| Molecular Formula | C3H7ClN2 |
| Molecular Weight | 106.5541 |
| SMILES | Cl.NCCC#N |
| Synonyms | 3-aminopropanenitrile hydrochloride,
646-03-7,
118926-34-4,
SCHEMBL2719729,
CTK5C1466,
DTXSID50482130,
SOWHACJNMKTTRC-UHFFFAOYSA-N,
3-aminopropanenitrile;hydrochloride,
AKOS015995084,
ACN-052165,
NE27988,
RP18870,
J-511721,
Z1895741700,
|
| Complexity | 49.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 106.03g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 6 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 106.553g/mol |
| Monoisotopic Mass | 106.03g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.8A^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