Cas no 354587-81-8 ( )
structure
Product Name:
CAS No:354587-81-8
MF:C7H9NOS
MW:155.217460393906
CID:920358
PubChem ID:18673052
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- SCHEMBL2463655
- 5-Thiazolecarboxaldehyde, 2-ethyl-4-methyl-
- NHEVNDJWJORHNV-UHFFFAOYSA-N
- 2-Ethyl-4-methyl-thiazole-5-carbaldehyde
- DB-284211
- 354587-81-8
- 2-ethyl-4-methylthiazole-5-carboxaldehyde
-
-
- Inchi： 1S/C7H9NOS/c1-3-7-8-5(2)6(4-9)10-7/h4H,3H2,1-2H3
- InChI Key： NHEVNDJWJORHNV-UHFFFAOYSA-N
- SMILES： S1C(C=O)=C(C)N=C1CC
Computed Properties
- Exact Mass: 155.04048508g/mol
- Monoisotopic Mass: 155.04048508g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 129
- 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: 58.2?2
Related Literature
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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