Cas no 84255-23-2 (1H-Imidazole-5-carboxylicacid, 2-heptadecyl-)
84255-23-2 structure
Product Name:1H-Imidazole-5-carboxylicacid, 2-heptadecyl-
CAS No:84255-23-2
MF:C21H38N2O2
MW:350.538626194
CID:724678
PubChem ID:3019801
Update Time:2025-04-19
1H-Imidazole-5-carboxylicacid, 2-heptadecyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole-5-carboxylicacid, 2-heptadecyl-
- 2-heptadecyl-1H-imidazole-4-carboxylic acid
- 2-heptadecyl-1H-imidazole-5-carboxylic acid
- 84255-23-2
- 1H-Imidazole-5-carboxylic acid, 2-heptadecyl-
- NS00038472
- SY310522
- DTXSID70233186
- EINECS 282-570-2
- T889DR9D4C
-
- Inchi： 1S/C21H38N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-22-18-19(23-20)21(24)25/h18H,2-17H2,1H3,(H,22,23)(H,24,25)
- InChI Key： NPSQOIASPSALLK-UHFFFAOYSA-N
- SMILES： OC(C1=CN=C(CCCCCCCCCCCCCCCCC)N1)=O
Computed Properties
- Exact Mass: 350.293328
- Monoisotopic Mass: 350.293328
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 25
- Rotatable Bond Count: 17
- Complexity: 323
- 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
- Topological Polar Surface Area: 66
- XLogP3: 8.7
Experimental Properties
- Density: 0.99
- Boiling Point: 539.9°C at 760 mmHg
- Flash Point: 280.3°C
- Refractive Index: 1.503
1H-Imidazole-5-carboxylicacid, 2-heptadecyl- Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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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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