Cas no 52726-30-4 (1H-Imidazole, 4-methyl-1-(phenylmethyl)-)
52726-30-4 structure
Product Name:1H-Imidazole, 4-methyl-1-(phenylmethyl)-
CAS No:52726-30-4
MF:C11H12N2
MW:172.226382255554
CID:336122
PubChem ID:11829920
Update Time:2025-04-19
1H-Imidazole, 4-methyl-1-(phenylmethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole, 4-methyl-1-(phenylmethyl)-
- 1-benzyl-4-methylimidazole
- DTXSID20474022
- SCHEMBL1196872
- 52726-30-4
-
- Inchi： 1S/C11H12N2/c1-10-7-13(9-12-10)8-11-5-3-2-4-6-11/h2-7,9H,8H2,1H3
- InChI Key： IXRPSXPLZBCCLC-UHFFFAOYSA-N
- SMILES： N1(C=NC(C)=C1)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 172.100048391g/mol
- Monoisotopic Mass: 172.100048391g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 152
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2
- Topological Polar Surface Area: 17.8?2
1H-Imidazole, 4-methyl-1-(phenylmethyl)- Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
52726-30-4 (1H-Imidazole, 4-methyl-1-(phenylmethyl)-) Related Products
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