Cas no 1093266-08-0 (2-cyclopropyl-4-methyl-1H-Imidazole-5-carboxylic acid ethyl ester)
1093266-08-0 structure
Product Name:2-cyclopropyl-4-methyl-1H-Imidazole-5-carboxylic acid ethyl ester
CAS No:1093266-08-0
MF:C10H14N2O2
MW:194.230362415314
CID:1098563
PubChem ID:68487395
Update Time:2025-04-20
2-cyclopropyl-4-methyl-1H-Imidazole-5-carboxylic acid ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-cyclopropyl-4-methyl-1H-Imidazole-5-carboxylic acid ethyl ester
- ethyl 2-cyclopropyl-4-methyl-1H-imidazole-5-carboxylate
- DA-34307
- 1093266-08-0
- SCHEMBL3033689
-
- Inchi： 1S/C10H14N2O2/c1-3-14-10(13)8-6(2)11-9(12-8)7-4-5-7/h7H,3-5H2,1-2H3,(H,11,12)
- InChI Key： ITODFXSXGQGKJZ-UHFFFAOYSA-N
- SMILES： O(CC)C(C1=C(C)NC(C2CC2)=N1)=O
Computed Properties
- Exact Mass: 194.105527694g/mol
- Monoisotopic Mass: 194.105527694g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 228
- 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: 1.6
- Topological Polar Surface Area: 55?2
2-cyclopropyl-4-methyl-1H-Imidazole-5-carboxylic acid ethyl ester Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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