Cas no 881409-85-4 (1H-Imidazole,5-(1-phenylethyl)-)
881409-85-4 structure
Product Name:1H-Imidazole,5-(1-phenylethyl)-
CAS No:881409-85-4
MF:C11H12N2
MW:172.226382255554
CID:710284
PubChem ID:16663244
Update Time:2024-10-26
1H-Imidazole,5-(1-phenylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole,5-(1-phenylethyl)-
- 1H-Imidazole, 4-(1-phenylethyl)- (9CI)
- 5-(1-Phenylethyl)-1H-imidazole (ACI)
- SCHEMBL2104149
- 4-(1-phenylethyl)-1H-imidazole
- 5-(1-phenyl-ethyl)-1h-imidazole
- 881409-85-4
- 1H-Imidazole, 5-(1-phenylethyl)-
- 5-(1-phenylethyl)-1H-imidazole
- FDKDATUVJLVLHB-UHFFFAOYSA-N
- EN300-1861835
-
- Inchi： 1S/C11H12N2/c1-9(11-7-12-8-13-11)10-5-3-2-4-6-10/h2-9H,1H3,(H,12,13)
- InChI Key： FDKDATUVJLVLHB-UHFFFAOYSA-N
- SMILES： N1C=C(C(C)C2C=CC=CC=2)NC=1
Computed Properties
- Exact Mass: 172.100048391g/mol
- Monoisotopic Mass: 172.100048391g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- 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 : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.3
- Topological Polar Surface Area: 28.7?2
1H-Imidazole,5-(1-phenylethyl)- Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：Store at recommended temperature
1H-Imidazole,5-(1-phenylethyl)- Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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5. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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