| CAS Number | 105026-85-5 |
| Catalog Number | AG01AAHX(AGN-PC-08XSJ9) |
| Chemical Name | 4-(Aminomethyl)-2-ethoxyphenol hydrochloride |
| IUPAC Name | 4-(aminomethyl)-2-ethoxyphenol;hydrochloride |
| InChI | InChI=1S/C9H13NO2.ClH/c1-2-12-9-5-7(6-10)3-4-8(9)11;/h3-5,11H,2,6,10H2,1H3;1H |
| InChI Key | USHFIWRLIIZZCA-UHFFFAOYSA-N |
| MDL Number | MFCD06797837 |
| Molecular Formula | C9H14ClNO2 |
| Molecular Weight | 203.6660 |
| SMILES | Cl.CCOC1=C(O)C=CC(CN)=C1 |
| Synonyms | 4-(aminomethyl)-2-ethoxyphenol hydrochloride,
105026-85-5,
AC1Q39YK,
SCHEMBL5065617,
AKOS024397927,
MCULE-1288672201,
NE51592,
4-hydroxy-3-ethoxybenzylamine hydrochloride,
EN300-68659,
Phenol, 4-(aminomethyl)-2-ethoxy-, hydrochloride,
Z1160899481,
2-ethoxy-4-aminomethyl-phenol, hydrochloride,
|
| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.666g/mol |
| Monoisotopic Mass | 203.071g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number