| CAS Number | 121489-79-0 |
| Catalog Number | AG019U92 |
| Chemical Name | 3-(4-aminophenoxy)propanamide |
| IUPAC Name | 3-(4-aminophenoxy)propanamide |
| InChI | InChI=1S/C9H12N2O2/c10-7-1-3-8(4-2-7)13-6-5-9(11)12/h1-4H,5-6,10H2,(H2,11,12) |
| InChI Key | CYFJIKZBCBBFIS-UHFFFAOYSA-N |
| MDL Number | MFCD11206018 |
| Molecular Formula | C9H12N2O2 |
| Molecular Weight | 180.2038 |
| SMILES | NC(CCOC1=CC=C(N)C=C1)=O |
| Synonyms | 3-(4-aminophenoxy)propanamide,
121489-79-0,
AC1Q4ZNG,
CTK7D3237,
ZINC32627934,
AKOS009329215,
MCULE-8752964019,
NE34162,
3-(4-aminophenoxy)propanamide, AldrichCPR,
EN300-40969,
Z415728104,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.207g/mol |
| Monoisotopic Mass | 180.09g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 78.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number