| CAS Number | 1049782-92-4 |
| Catalog Number | AG0094CG(AGN-PC-0WADYZ) |
| Chemical Name | Methyl 5-(aminomethyl)-2-methoxybenzoate, HCl |
| IUPAC Name | methyl 5-(aminomethyl)-2-methoxybenzoate;hydrochloride |
| InChI | InChI=1S/C10H13NO3.ClH/c1-13-9-4-3-7(6-11)5-8(9)10(12)14-2;/h3-5H,6,11H2,1-2H3;1H |
| InChI Key | FWUSELINWADQCC-UHFFFAOYSA-N |
| MDL Number | MFCD07285352 |
| Molecular Formula | C10H14ClNO3 |
| Molecular Weight | 231.6761 |
| SMILES | Cl.COC(C1=C(OC)C=CC(CN)=C1)=O |
| Synonyms | methyl 5-(aminomethyl)-2-methoxybenzoate hydrochloride,
1049782-92-4,
Methyl 5-(aminomethyl)-2-methoxybenzoate, HCl,
AC1Q3BW4,
CTK7E4117,
MFCD07285352,
AKOS026672399,
MCULE-1402825166,
NE26271,
Z6778,
EN300-08509,
Methyl 5-(aminomethyl)-2-methoxybenzoate HCl,
Z56939283,
C10H13NO3.HCl,
|
| Complexity | 196 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.676g/mol |
| Monoisotopic Mass | 231.066g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 61.6A^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