| CAS Number | 112103-97-6 |
| Catalog Number | AG019MB2(AGN-PC-0NKPLV) |
| Chemical Name | 4-(3-Aminopropyl)-N,N-dimethylaniline |
| IUPAC Name | 4-(3-aminopropyl)-N,N-dimethylaniline |
| InChI | InChI=1S/C11H18N2/c1-13(2)11-7-5-10(6-8-11)4-3-9-12/h5-8H,3-4,9,12H2,1-2H3 |
| InChI Key | FDADHKBMNOCRMW-UHFFFAOYSA-N |
| MDL Number | MFCD09886638 |
| Molecular Formula | C11H18N2 |
| Molecular Weight | 178.2740 |
| SMILES | CN(C)C1=CC=C(CCCN)C=C1 |
| Synonyms | 4-(3-aminopropyl)-N,N-dimethylaniline,
112103-97-6,
N-[4-(3-aminopropyl)phenyl]-N,N-dimethylamine,
F2188-0015,
AC1Q3WDG,
SCHEMBL3221096,
CTK7E7811,
DTXSID60577066,
SBB084417,
ZINC11570840,
AKOS005217366,
AB54559,
MCULE-6227149064,
NE48511,
[4-(3-aminopropyl)phenyl]dimethylamine,
EN300-35639,
Z1245664701,
|
| Complexity | 126 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.279g/mol |
| Monoisotopic Mass | 178.147g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number