| CAS Number | 38710-60-0 |
| Catalog Number | AG01AACK(AGN-PC-00N819) |
| Chemical Name | 3-(4-Aminophenyl)propanamide |
| IUPAC Name | 3-(4-aminophenyl)propanamide |
| InChI | InChI=1S/C9H12N2O/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5H,3,6,10H2,(H2,11,12) |
| InChI Key | WICPORLNXBPBPR-UHFFFAOYSA-N |
| MDL Number | MFCD11638247 |
| Molecular Formula | C9H12N2O |
| Molecular Weight | 164.2044 |
| SMILES | O=C(N)CCC1=CC=C(N)C=C1 |
| Synonyms | 3-(4-aminophenyl)propanamide,
38710-60-0,
4-Amino-benzenepropanamide,
AC1Q4ZM1,
SCHEMBL987884,
CHEMBL151950,
p-amino-hydrocinnamic acid amide,
3-(4-Amino-phenyl)-propionamide,
WICPORLNXBPBPR-UHFFFAOYSA-N,
ZINC27617505,
AKOS009448099,
MCULE-9065854031,
NE58935,
3-(4-aminophenyl)propanamide, AldrichCPR,
EN300-68211,
AE-562/43460369,
Z1160900197,
|
| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.208g/mol |
| Monoisotopic Mass | 164.095g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 69.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number