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- chem960
- 2902-99-0
- Benzeneacetic acid, a-phenyl-, 2-(diethylamino)propylester
- 2-(diethylamino)propyl 2,2-diphenylacetate
- ACETIC ACID, 2,2-DIPHENYL-, 2-(DIETHYLAMINO)PROPYL ESTER
- BRN 2471488
- 2-(diethylamino)propyl diphenylacetate
- 2902-99-0
- DTXSID80951627
- 2,2-Diphenylacetic acid 2-(diethylamino)propyl ester
- 2-(Diethylamino)propyl 2,2-diphenylacetate
- InChIKey：UQSAURXCYOSILU-UHFFFAOYSA-N
- Inchi：InChI=1S/C21H27NO2/c1-4-22(5-2)17(3)16-24-21(23)20(18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17,20H,4-5,16H2,1-3H3
- SMILES：CCN(C(COC(C(C1=CC=CC=C1)C1=CC=CC=C1)=O)C)CC
Computed Properties
- Exact Mass: 325.20431
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Rotatable Bond Count: 9
- Monoisotopic Mass: 325.204
- Heavy Atom Count: 24
- Complexity: 337
- Isotope Atom Count: 0
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Covalently-Bonded Unit Count: 1
- XLogP3: 4.6
- Topological Polar Surface Area: 29.5A^2
Experimental Properties
- PSA: 29.54
- Refractive Index: 1.539
- Boiling Point: 431.7°Cat760mmHg
- Flash Point: 131°C
- Density: 1.04
-
adiphenine CAS No.: 64-95-9
