| CAS Number | 210113-85-2 |
| Catalog Number | AG01AGUX(AGN-PC-08XSRV) |
| Chemical Name | Methyl 4-(2-aminoethoxy)benzoate hydrochloride |
| IUPAC Name | methyl 4-(2-aminoethoxy)benzoate;hydrochloride |
| InChI | InChI=1S/C10H13NO3.ClH/c1-13-10(12)8-2-4-9(5-3-8)14-7-6-11;/h2-5H,6-7,11H2,1H3;1H |
| InChI Key | YKKLMHVRCUIUIT-UHFFFAOYSA-N |
| MDL Number | MFCD16617505 |
| Molecular Formula | C10H14ClNO3 |
| Molecular Weight | 231.6761 |
| SMILES | Cl.NCCOC1=CC=C(C(=O)OC)C=C1 |
| Synonyms | methyl 4-(2-aminoethoxy)benzoate hydrochloride,
210113-85-2,
EN300-72916,
AC1Q3BWF,
SCHEMBL442778,
YKKLMHVRCUIUIT-UHFFFAOYSA-N,
MCULE-9110515841,
NE61790,
Methyl 4-(2-aminoethoxyl)benzoate hydrochloride,
methyl 4-(2-amino-ethoxy)benzoate hydrochloride,
4-(2-aminoethoxy)benzoic acid methyl ester hydrochloride,
Z1473961797,
4-(2-aminoethoxyl)benzoic acid methyl ester hydrochloride,
methyl 4-(2-Aminoethyloxy)benzoate hcl,
|
| Complexity | 176 |
| 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 | 5 |
| Topological Polar Surface Area | 61.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number