| CAS Number | 926189-99-3 |
| Catalog Number | AG00IH82(AGN-PC-0WOKFG) |
| Chemical Name | N,N-Diethyl 4-(Aminomethyl)benzamide |
| IUPAC Name | 4-(aminomethyl)-N,N-diethylbenzamide |
| InChI | InChI=1S/C12H18N2O/c1-3-14(4-2)12(15)11-7-5-10(9-13)6-8-11/h5-8H,3-4,9,13H2,1-2H3 |
| InChI Key | UCWAKSWBYWRMKW-UHFFFAOYSA-N |
| MDL Number | MFCD08443071 |
| Molecular Formula | C12H18N2O |
| Molecular Weight | 206.2841 |
| SMILES | CCN(C(C1=CC=C(CN)C=C1)=O)CC |
| Synonyms | 4-(aminomethyl)-N,N-diethylbenzamide,
N,N-Diethyl 4-(Aminomethyl)benzamide,
926189-99-3,
AC1Q2YSQ,
SCHEMBL19634392,
CTK6E6734,
KM3558,
MFCD08443071,
ZINC19722284,
AKOS000125968,
MCULE-4690998872,
EN300-37428,
Z228584480,
|
| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.289g/mol |
| Monoisotopic Mass | 206.142g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number