| CAS Number | 6440-96-6 |
| Catalog Number | AG019S4Y(AGN-PC-0TCILO) |
| Chemical Name | 2-(3-methoxyphenoxy)propan-1-amine |
| IUPAC Name | 2-(3-methoxyphenoxy)propan-1-amine |
| InChI | InChI=1S/C10H15NO2/c1-8(7-11)13-10-5-3-4-9(6-10)12-2/h3-6,8H,7,11H2,1-2H3 |
| InChI Key | LFNKWOWDZXYENJ-UHFFFAOYSA-N |
| MDL Number | MFCD07374160 |
| Molecular Formula | C10H15NO2 |
| Molecular Weight | 181.2316 |
| SMILES | COC1=CC(OC(CN)C)=CC=C1 |
| Synonyms | 1-[(1-AMINOPROPAN-2-YL)OXY]-3-METHOXYBENZENE,
6440-96-6,
2-(3-METHOXYPHENOXY)PROPAN-1-AMINE,
SCHEMBL20508645,
AKOS010957853,
AB38905,
MCULE-3643886773,
NE13655,
EN300-91793,
Z1263580024,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.235g/mol |
| Monoisotopic Mass | 181.11g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number