| CAS Number | 1183730-87-1 |
| Catalog Number | AG019S72 |
| Chemical Name | 1-[(4-Aminophenyl)methyl]-3-ethylurea |
| IUPAC Name | 1-[(4-aminophenyl)methyl]-3-ethylurea |
| InChI | InChI=1S/C10H15N3O/c1-2-12-10(14)13-7-8-3-5-9(11)6-4-8/h3-6H,2,7,11H2,1H3,(H2,12,13,14) |
| InChI Key | PAWXMMUWAPSTIM-UHFFFAOYSA-N |
| MDL Number | MFCD12763341 |
| Molecular Formula | C10H15N3O |
| Molecular Weight | 193.2456 |
| SMILES | CCNC(NCC1=CC=C(N)C=C1)=O |
| Synonyms | 1-[(4-aminophenyl)methyl]-3-ethylurea,
1183730-87-1,
SCHEMBL15652114,
ZINC37666355,
AKOS010097953,
MCULE-2544035306,
NE45111,
EN300-92027,
Z1266933943,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.122g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.25g/mol |
| Monoisotopic Mass | 193.122g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number