| CAS Number | 332363-16-3 |
| Catalog Number | AG00COWX |
| Chemical Name | 3-(3-Aminopropyl)aniline |
| IUPAC Name | 3-(3-aminopropyl)aniline |
| InChI | InChI=1S/C9H14N2/c10-6-2-4-8-3-1-5-9(11)7-8/h1,3,5,7H,2,4,6,10-11H2 |
| InChI Key | LPCINXWHNYBINL-UHFFFAOYSA-N |
| MDL Number | MFCD07644610 |
| Molecular Formula | C9H14N2 |
| Molecular Weight | 150.2209 |
| SMILES | NCCCC1=CC(N)=CC=C1 |
| Synonyms | 3-(3-aminopropyl)aniline,
332363-16-3,
3-(3-amino-propyl)-aniline,
Benzenepropanamine, 3-amino- (9CI),
3-aminoBenzenepropanamine,
SCHEMBL951868,
CTK4H0239,
DTXSID90616578,
BENZENEPROPANAMINE, 3-AMINO-,
ZINC58003730,
AKOS006286340,
DA-06794,
FT-0721283,
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| Complexity | 104 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 150.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 150.225g/mol |
| Monoisotopic Mass | 150.116g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number