2-Phenylisoindolin-1-One 2,3-二氢-2-苯基-1H-异吲哚-1-酮

CAS 5388-42-1 MFCD00023020

化学结构图

5388-42-1
SMILES: O=C1c2ccccc2CN1c1ccccc1

化学属性

Mol. FormulaC14H11NO
Mol. Weight209.24
Boiling Point378.2°C at 760 mmHg
Melting Point162.5 °C

别名和识别编码

Chemical Name2-Phenylisoindolin-1-One
InChIKeyFIWLYGQHSKZFAQ-UHFFFAOYSA-N
Wiswesser Line NotationT56 BVN DHJ CR
Synonym 2-Phenylisoindolin-1-one {LY} 2-Phenylisoindolin-1-one {} {LY} 2-Phenylisoindolin-1-one {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {} {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {} {} {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {} {} {} {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {} {} {} {} {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenylisoindolin-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenylisoindo
CAS Number5388-42-1
Beilstein Registry Number0149773
Chemical Name Translation2,3-二氢-2-苯基-1H-异吲哚-1-酮
LabNetwork Molecule IDLN00252254
PubChem Substance ID97035
InChIInChI=1S/C14H11NO/c16-14-13-9-5-4-6-11(13)10-15(14)12-7-2-1-3-8-12/h1-9H,10H2
Canonical SMILESC1=CC=C(C=C1)N2CC3=CC=CC=C3C2=O
MDL NumberMFCD00023020
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安全信息

RTECSTI5696000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 56 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#04554

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 450 mg/kg
SEX/DURATION            : female 8-10 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - post-implantation mortality (e.g. dead and/or
   resorbed implants per total number of implants)
   Reproductive - Effects on Embryo or Fetus - fetal death
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
   TJADAB Teratology, The International Journal of Abnormal Development. (Alan
   R. Liss, Inc., 41 E. 11th St., New York, NY 10003)  V.1-    1968-
   Volume(issue)/page/year: 19,341,1979

Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {}

系列性分类

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