| CAS Number | 5689-74-7 |
| Catalog Number | AG00EV8C(AGN-PC-0SML6U) |
| Chemical Name | 1,3-diphenylpropan-1-amine |
| EC Number | 227-158-5 |
| IUPAC Name | 1,3-diphenylpropan-1-amine |
| InChI | InChI=1S/C15H17N/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-10,15H,11-12,16H2 |
| InChI Key | ABMVTYGGTMHHTN-UHFFFAOYSA-N |
| MDL Number | MFCD09813589 |
| Molecular Formula | C15H17N |
| Molecular Weight | 211.3022 |
| SMILES | NC(C1=CC=CC=C1)CCC1=CC=CC=C1 |
| Synonyms | 1,3-Diphenylpropylamine,
1,3-diphenylpropan-1-amine,
5689-74-7,
EINECS 227-158-5,
1,3-Diphenyl-1-propanamine,
Benzenepropanamine, a-phenyl-,
SCHEMBL855071,
AC1L384K,
CTK5A5876,
AKOS000169026,
MCULE-9522447398,
NCGC00333860-01,
EN300-58283,
AB01320311-02,
NSC23036,
C15-H17-N,
CID110690,
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| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.308g/mol |
| Monoisotopic Mass | 211.136g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number