| CAS Number | 953734-60-6 |
| Catalog Number | AG019LHT(AGN-PC-0WODFG) |
| Chemical Name | N-[4-(1-AMINOETHYL)PHENYL]CYCLOPROPANECARBOXAMIDE |
| IUPAC Name | N-[4-(1-aminoethyl)phenyl]cyclopropanecarboxamide |
| InChI | InChI=1S/C12H16N2O/c1-8(13)9-4-6-11(7-5-9)14-12(15)10-2-3-10/h4-8,10H,2-3,13H2,1H3,(H,14,15) |
| InChI Key | CELFORIQAQLUCB-UHFFFAOYSA-N |
| MDL Number | MFCD09735439 |
| Molecular Formula | C12H16N2O |
| Molecular Weight | 204.2682 |
| SMILES | O=C(C1CC1)NC2=CC=C(C(C)N)C=C2 |
| Synonyms | N-[4-(1-aminoethyl)phenyl]cyclopropanecarboxamide,
953734-60-6,
AC1Q2B8F,
CTK6A5129,
AKOS000143442,
AKOS022477910,
MCULE-6992867520,
NE14347,
EN300-31305,
|
| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.273g/mol |
| Monoisotopic Mass | 204.126g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number