| CAS Number | 1986860-12-1 |
| Catalog Number | AG01DMMB |
| Chemical Name | methyl 3-(aminomethyl)thiophene-2-carboxylate hydrochloride |
| IUPAC Name | methyl 3-(aminomethyl)thiophene-2-carboxylate;hydrochloride |
| InChI | InChI=1S/C7H9NO2S.ClH/c1-10-7(9)6-5(4-8)2-3-11-6;/h2-3H,4,8H2,1H3;1H |
| InChI Key | ZCEHNTHTIBAMKH-UHFFFAOYSA-N |
| MDL Number | MFCD26407240 |
| Molecular Formula | C7H10ClNO2S |
| Molecular Weight | 207.6778 |
| SMILES | Cl.COC(C1=C(CN)C=CS1)=O |
| Synonyms | 79472-21-2,
METHYL 3-(AMINOMETHYL)THIOPHENE-2-CARBOXYLATE HCL,
Methyl 3-(aminomethyl)thiophene-2-carboxylate hydrochloride,
DTXSID40857393,
AKOS027339372,
Methyl 3-(aminomethyl)thiophene-2-carboxylate--hydrogen chloride (1/1),
1986860-12-1,
|
| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.012g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.672g/mol |
| Monoisotopic Mass | 207.012g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 80.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number