| CAS Number | 1803580-89-3 |
| Catalog Number | AG00I01F(AGN-PC-0WO8C4) |
| Chemical Name | 1-(3-(Aminomethyl)azetidin-1-yl)ethanone hcl |
| IUPAC Name | 1-[3-(aminomethyl)azetidin-1-yl]ethanone;hydrochloride |
| InChI | InChI=1S/C6H12N2O.ClH/c1-5(9)8-3-6(2-7)4-8;/h6H,2-4,7H2,1H3;1H |
| InChI Key | LHAAXEXGKHVPCI-UHFFFAOYSA-N |
| MDL Number | MFCD16620215 |
| Molecular Formula | C6H13ClN2O |
| Molecular Weight | 164.6332 |
| SMILES | Cl.CC(N1CC(CN)C1)=O |
| Synonyms | 1803580-89-3,
1-(3-(Aminomethyl)azetidin-1-yl)ethanone HCl,
1-(3-(Aminomethyl)azetidin-1-yl)ethanone hydrochloride,
1-[3-(aminomethyl)azetidin-1-yl]ethan-1-one hydrochloride,
MFCD16620215,
AKOS026728776,
NE52436,
EN300-170410,
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| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.633g/mol |
| Monoisotopic Mass | 164.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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