1-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]-3-(hydroxymethyl)benzimidazol-2-one

Modify Date: 2025-09-27 13:59:23

1-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]-3-(hydroxymethyl)benzimidazol-2-one Structure
1-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]-3-(hydroxymethyl)benzimidazol-2-one structure
 Common Name 1-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]-3-(hydroxymethyl)benzimidazol-2-one
CAS Number 1814-13-7 Molecular Weight 411.46900
Density 1.281g/cm3 Boiling Point 582ºC at 760 mmHg
Molecular Formula C23H26FN3O3 Melting Point N/A
MSDS N/A Flash Point 305.8ºC

 Names

Name 1-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]-3-(hydroxymethyl)benzimidazol-2-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.281g/cm3
Boiling Point 582ºC at 760 mmHg
Molecular Formula C23H26FN3O3
Molecular Weight 411.46900
Flash Point 305.8ºC
Exact Mass 411.19600
PSA 67.47000
LogP 3.12980
Vapour Pressure 2.17E-14mmHg at 25°C
Index of Refraction 1.607
InChIKey ACQRYVMWVNCRDN-UHFFFAOYSA-N
SMILES O=C(CCCN1CCC(n2c(=O)n(CO)c3ccccc32)CC1)c1ccc(F)cc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DE1940000
CHEMICAL NAME :
2-Benzimidazolinone, 1-(1-(3-(p-fluorobenzoyl)propyl)-4-piperidyl)-3-hydro xymethyl-
CAS REGISTRY NUMBER :
1814-13-7
BEILSTEIN REFERENCE NO. :
0902604
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C23-H26-F-N3-O3
MOLECULAR WEIGHT :
411.52
WISWESSER LINE NOTATION :
T56 BNVNJ B1Q D- DT6NTJ A3VR DF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
32 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#11205

 Synonyms

1-{1-[4-(4-fluoro-phenyl)-4-oxo-butyl]-piperidin-4-yl}-3-hydroxymethyl-1,3-dihydro-benzoimidazol-2-one
2-Benzimidazolinone,1-(1-(3-(p-fluorobenzoyl)propyl)-4-piperidyl)-3-hydroxymethyl
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Chemsrc provides CAS#:1814-13-7 MSDS, density, melting point, boiling point, structure, etc. Its name is 1-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]-3-(hydroxymethyl)benzimidazol-2-one>> amp version: 1-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]-3-(hydroxymethyl)benzimidazol-2-one

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