| CAS Number | 191165-22-7 |
| Catalog Number | AG01A9V4(AGN-PC-05DDBV) |
| Chemical Name | 3-[(4-methoxyphenyl)methoxy]propan-1-amine |
| IUPAC Name | 3-[(4-methoxyphenyl)methoxy]propan-1-amine |
| InChI | InChI=1S/C11H17NO2/c1-13-11-5-3-10(4-6-11)9-14-8-2-7-12/h3-6H,2,7-9,12H2,1H3 |
| InChI Key | AQJLVDMLUDKTAQ-UHFFFAOYSA-N |
| MDL Number | MFCD11147573 |
| Molecular Formula | C11H17NO2 |
| Molecular Weight | 195.2582 |
| SMILES | COC1=CC=C(COCCCN)C=C1 |
| Synonyms | 3-[(4-methoxyphenyl)methoxy]propan-1-amine,
191165-22-7,
3-((4-Methoxybenzyl)oxy)propan-1-amine,
AC1Q4CU7,
ZINC19965668,
AKOS000246695,
MCULE-7225635606,
NE14996,
EN300-66244,
Z1373589143,
|
| Complexity | 133 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.262g/mol |
| Monoisotopic Mass | 195.126g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number