| CAS Number | 918810-76-1 |
| Catalog Number | AG006BUN(AGN-PC-01672N) |
| Chemical Name | N-[3-(1-aminoethyl)phenyl]acetamide |
| IUPAC Name | N-[3-(1-aminoethyl)phenyl]acetamide |
| InChI | InChI=1S/C10H14N2O/c1-7(11)9-4-3-5-10(6-9)12-8(2)13/h3-7H,11H2,1-2H3,(H,12,13) |
| InChI Key | MKUVXAZZKXTGOK-UHFFFAOYSA-N |
| MDL Number | MFCD09738445 |
| Molecular Formula | C10H14N2O |
| Molecular Weight | 178.2310 |
| SMILES | CC(C1=CC(NC(C)=O)=CC=C1)N |
| Synonyms | N-[3-(1-aminoethyl)phenyl]acetamide,
918810-76-1,
N-(3-(1-Aminoethyl)phenyl)acetamide,
Acetamide, N-[3-(1-aminoethyl)phenyl]-,
AC1Q2B7O,
SCHEMBL4362389,
CTK3H5841,
DTXSID10588566,
MKUVXAZZKXTGOK-UHFFFAOYSA-N,
AKOS000145562,
AKOS022475126,
MCULE-7878560094,
NE27501,
EN300-31179,
Z1262254296,
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| Complexity | 182 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.235g/mol |
| Monoisotopic Mass | 178.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number