| CAS Number | 1638761-28-0 |
| Catalog Number | AG01DXQA(AGN-PC-0WD8SQ) |
| Chemical Name | Methyl3-(aminomethyl)bicyclo[1.1.1]pentane-1-carboxylatehydrochloride |
| IUPAC Name | methyl 3-(aminomethyl)bicyclo[1.1.1]pentane-1-carboxylate;hydrochloride |
| InChI | InChI=1S/C8H13NO2.ClH/c1-11-6(10)8-2-7(3-8,4-8)5-9;/h2-5,9H2,1H3;1H |
| InChI Key | HVQDRPIJUBUWEO-UHFFFAOYSA-N |
| MDL Number | MFCD27987009 |
| Molecular Formula | C8H14ClNO2 |
| Molecular Weight | 191.6553 |
| SMILES | Cl.NCC12CC(C1)(C2)C(=O)OC |
| Synonyms | 1638761-28-0,
Methyl 3-(aminomethyl)bicyclo[1.1.1]pentane-1-carboxylate hydrochloride,
methyl3-(aminomethyl)bicyclo[1.1.1]pentane-1-carboxylatehydrochloride,
SB11713,
OR312482,
CS-0055560,
3-AMINOMETHYL-BICYCLO[1.1.1]PENTANE-1-CARBOXYLIC ACID METHYL ESTER HCL,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.655g/mol |
| Monoisotopic Mass | 191.071g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number