| CAS Number | 1081777-51-6 |
| Catalog Number | AG01AICD |
| Chemical Name | 2-(Aminomethyl)-4-methoxyphenol hydrochloride |
| IUPAC Name | 2-(aminomethyl)-4-methoxyphenol;hydrochloride |
| InChI | InChI=1S/C8H11NO2.ClH/c1-11-7-2-3-8(10)6(4-7)5-9;/h2-4,10H,5,9H2,1H3;1H |
| InChI Key | NSZHUAYDQUDMDY-UHFFFAOYSA-N |
| MDL Number | MFCD18838996 |
| Molecular Formula | C8H12ClNO2 |
| Molecular Weight | 189.6394 |
| SMILES | OC1=CC=C(OC)C=C1CN.[H]Cl |
| Synonyms | 2-(aminomethyl)-4-methoxyphenol hydrochloride,
1081777-51-6,
MCULE-1030788840,
NE33283,
EN300-77379,
Z1268152343,
|
| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.639g/mol |
| Monoisotopic Mass | 189.056g/mol |
| Rotatable Bond Count | 2 |
| 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