| CAS Number | 1094322-85-6 |
| Catalog Number | AG019WK2 |
| Chemical Name | 3-(3-aminophenoxy)propanamide |
| IUPAC Name | 3-(3-aminophenoxy)propanamide |
| InChI | InChI=1S/C9H12N2O2/c10-7-2-1-3-8(6-7)13-5-4-9(11)12/h1-3,6H,4-5,10H2,(H2,11,12) |
| InChI Key | LMXQTCUHWPVFSA-UHFFFAOYSA-N |
| MDL Number | MFCD11206020 |
| Molecular Formula | C9H12N2O2 |
| Molecular Weight | 180.2038 |
| SMILES | NC(CCOC1=CC(N)=CC=C1)=O |
| Synonyms | 3-(3-aminophenoxy)propanamide,
1094322-85-6,
AC1Q4ZNF,
CTK7D3238,
ZINC36379852,
AKOS009329217,
MCULE-3603023185,
NE60492,
3-(3-aminophenoxy)propanamide, AldrichCPR,
EN300-52208,
Z752989160,
|
| Complexity | 173 |
| 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 |
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Certificate of Analysis
Lot Number