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CAS Number: 60373-71-9
1-(1-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-benzo[d]imidazol-2(3H)-one

Structure

1-(1-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-benzo[d]imidazol-2(3H)-one
Name: 1-(1-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-benzo[d]imidazol-2(3H)-one
Synonyms:
General Information
Product Number: 60373719
CAS Registry Number: 60373-71-9
Name:
        2H-​Benzimidazol-​2-​one, 1,​3-​dihydro-​1-​[1,​2,​3,​6-​tetrahydro-​1-​(phenylmethyl)​-​4-​pyridinyl]​-
        2-​Benzimidazolinone, 1-​(1-​benzyl-​1,​2,​3,​6-​tetrahydro-​4-​pyridyl)​- (6CI); NSC 75896 
 
Chemical Formula: C19H19N3O
Exact Mass: 305.15
Molecular Weight: 305.37
m/z: 305.15 (100.0%), 306.16 (20.8%), 307.16 (2.3%), 306.15 (1.1%)
Elemental Analysis: C, 74.73; H, 6.27; N, 13.76; O, 5.24
 
InChI: InChI=1S/C19H19N3O/c23-19-20-17-8-4-5-9-18(17)22(19)16-10-12-21(13-11-16)14-15-6-2-1-3-7-15/h1-10H,11-14H2,(H,20,23)
InChIKey: FKCKAEJWXGMCFZ-UHFFFAOYSA-N
Canonical SMILES : C1CN(CC=C1N2C3=CC=CC=C3NC2=O)CC4=CC=CC=C4
 
Thermal Properties Value Condition Note
Melting Point 160-162 °C   (4)CAS
Melting Point 159-160 °C   (2)CAS

Specification

98%

References
  1. (1) BIORAD: Copyright Bio-Rad Laboratories. All Rights Reserved.
  2. (2) Kuethe, Jeffrey T.; Tetrahedron 2007, V63(46), P11489-11502 CAPLUS
  3. (3) BIORAD: Infrared spectral data from the Bio-Rad/Sadtler IR Data Collection was obtained from Bio-Rad Laboratories, Philadelphia, PA (US). Copyright © Bio-Rad Laboratories. All Rights Reserved.
  4. (4) Rossi, A.; Helvetica Chimica Acta 1960, V43, P1298-313;English summary 1313 CAPLUS
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