2-Butyn-1-ol, 1,1-diphenyl-4-(1-pyrrolidinyl)- 1,1-二苯基-4-(吡咯烷-1-基)丁-2-炔-1-醇

CAS 968-63-8 MFCD00865199

化学结构图

968-63-8
SMILES: OC(C#CCN1CCCC1)(c1ccccc1)c1ccccc1

化学属性

Mol. FormulaC20H21NO
Mol. Weight291.39
Melting Point152 °C
Boiling Point475.4±45.0 °C at 760 mmHg

别名和识别编码

Chemical Name2-Butyn-1-ol, 1,1-diphenyl-4-(1-pyrrolidinyl)-
Wiswesser Line NotationT5NTJ A2UU1XQR&R
Synonym 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {} {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {} {} {} {} {} {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {} {} {} {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {} {} {} {} {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {} {} {} {} {} {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {} {} {} {} {} {} {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {} {} {} {} {} {} {} {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {} {} {} {} {} {} {} {} {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {} {} {} {} {} {} {} {} {} {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {} {} {} {} {} {} {} {} {} {} {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,1-Diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol {} {} {} {} {} {} {} {} {}
CAS Number968-63-8
Beilstein Registry Number1388528
PubChem Substance ID68943
InChIInChI=1S/C20H21NO/c22-20(18-10-3-1-4-11-18,19-12-5-2-6-13-19)14-9-17-21-15-7-8-16-21/h1-6,10-13,22H,7-8,15-17H2
LabNetwork Molecule IDLN00263550
Chemical Name Translation1,1-二苯基-4-(吡咯烷-1-基)丁-2-炔-1-醇
Canonical SMILESC1=CC=C(C=C1)C(C#CCN2CCCC2)(C3=CC=CC=C3)O
MDL NumberMFCD00865199
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安全信息

RTECSES0779000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 75 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   MPHEAE Medicina et Pharmacologia Experimentalis.  (Basel, Switzerland)
   V.12-17, 1965-67.  For publisher information, see PHMGBN.
   Volume(issue)/page/year: 13,325,1965

Storage condition

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