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adiphenine | 64-95-9
64-95-9

Productnaam:adiphenine

CAS-nummer:64-95-9
MF:C20H25NO2
MW:311.418
CID:81638
PubChem ID:2031
Naam en identificatie
  • adiphenine
  • 2-(diethylamino)ethyl 2,2-diphenylacetate
  • 2-Diethylaminoethyl diphenylacetate
  • 2-Diethylaminoethylester kyseliny difenyloctove
  • Acetic acid, diphenyl-, 2-(diethylamino)ethyl ester
  • Adiphenin
  • Difacil
  • Diphacil
  • Diphacyl
  • Diphenylacetic acid diethylaminoethyl ester
  • Diphenylacetic acid, 2-(diethylamino)ethyl ester
  • Diphenylacetyldiethylaminoethanol
  • Patrovine
  • SKF 962A
  • Spasmolytin
  • Transentine
  • Tranzetil
  • Trasentin
  • Trasentine
  • Trazentyna
  • Vegantine
  • Wegantyna
  • BRD-K60907894-003-14-4
  • Adipheninum
  • CBDivE_011564
  • SPBio_001593
  • CAS-50-42-0
  • ADIPHENINE [MI]
  • Adiphenine [INN]
  • Prestwick1_000075
  • ADIPHENINE [HSDB]
  • NINDS_000221
  • NSC129224
  • BENZENEACETIC ACID, .ALPHA.-PHENYL-2-(DIETHYLAMINO)ETHYL ESTER
  • KBio2_001796
  • Adifenina
  • AB00053636_14
  • 2,2-diphenylacetic acid 2-(diethylamino)ethyl ester
  • 2-Diethylaminoethylester kyseliny difenyloctove [Czech]
  • BRN 1887268
  • HSDB 3282
  • SPBio_002210
  • YKG6OR043Q
  • ADIPHENINE [WHO-DD]
  • Diphenylessigsaeure-beta-diethylaminoethylester
  • Acetic acid, diphenyl-, 2-(diethylamino)ester
  • Prestwick2_000075
  • Wegantyna [Polish]
  • BSPBio_000289
  • ADIPHENINE [MART.]
  • BRD-K60907894-003-04-5
  • AKOS003656896
  • 2-diethylaminoethyl 2,2-diphenylacetate
  • KBioSS_001796
  • Spectrum5_001260
  • UNII-YKG6OR043Q
  • Q4057596
  • Adiphenine chloride (Salt/Mix)
  • Spectrum2_001517
  • Ester dwuetyloaminoetylowy kwasu dwufenylooctowego [Polish]
  • Trazentyna [Polish]
  • KBioGR_001394
  • DivK1c_000221
  • IDI1_000221
  • 64-95-9
  • BDBM50395519
  • Diphenylacetate du diethylamino-ethanol
  • KBio1_000221
  • SBI-0051763.P002
  • NS00006612
  • Benzeneacetic acid, alpha-phenyl-, 2-(diethylamino)ethyl ester
  • DTXSID0022561
  • JGOAIQNSOGZNBX-UHFFFAOYSA-N
  • EINECS 200-599-0
  • Benzeneacetic acid, alpha-phenyl-, 2-(diethylamino)ethyl ester,
  • CHEMBL353846
  • Spectrum4_001067
  • Benzeneacetic acid, .alpha.-phenyl-, 2-(diethylamino)ethyl ester
  • Diphenylacetic acid 2-(diethylamino)ethyl ester
  • BPBio1_000319
  • NCGC00016221-01
  • NCGC00016221-02
  • Adipheninum [INN-Latin]
  • Spectrum3_000954
  • CBDivE_014652
  • Adifenina [INN-Spanish]
  • Spectrum_001316
  • 2-(Diethylamino)ethyl diphenylacetate
  • KBio2_006932
  • NCGC00016221-03
  • Ester dwuetyloaminoetylowy kwasu dwufenylooctowego
  • CHEBI:94680
  • NCGC00016221-04
  • Benzeneacetic acid, alpha-phenyl-, 2-(diethylamino)ethyl ester, (9CI)
  • Prestwick3_000075
  • KBio3_002048
  • AB00053636_13
  • KBio2_004364
  • Ethanol, 2-(diethylamino)-, 2,2-diphenylacetate
  • Diphenylacetyldiethylaminoethyl
  • AB00053636
  • 4-09-00-02497 (Beilstein Handbook Reference)
  • Prestwick0_000075
  • SCHEMBL248213
  • InChIKey:JGOAIQNSOGZNBX-UHFFFAOYSA-N
  • Inchi:InChI=1S/C20H25NO2/c1-3-21(4-2)15-16-23-20(22)19(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,19H,3-4,15-16H2,1-2H3
  • SMILES:CCN(CCOC(C(C1=CC=CC=C1)C1=CC=CC=C1)=O)CC
Chemische en fysische eigenschappen

Berekende eigenschappen

  • Exacte massa: 311.18865
  • Aantal waterstofbonddonors: 0
  • Aantal waterstofbondacceptatoren: 3
  • Aantal draaibare bindingen: 9
  • Monoisotopische massa: 311.188529
  • Zware atoomtelling: 23
  • Complexiteit: 311
  • Aantal isotopen atomen: 0
  • Gedefinieerd atoomstereocentrumaantal: 0
  • Ongedefinieerd atoomstereocentrumaantal: 0
  • Gedefinieerd stereocenter aantal obligaties: 0
  • Ongedefinieerd stereocenter aantal bindingen: 0
  • Aantal covalent gebonden eenheden: 1
  • XLogP3: 4.2
  • Topologisch pooloppervlak: 29.5

Experimentele eigenschappen

  • LogboekP: 3.70350
  • PSA: 29.54
  • Brekindex: 1.5614 (estimate)
  • Kookpunt: 451.46°C (rough estimate)
  • Smeltpunt: 113.5°C
  • Vlampunt: 133.2°C
  • Dichtheid: 1.0899 (rough estimate)
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