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Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate

CAS No.:
161798-03-4
Catalog Number:
AG001VVV
Molecular Formula:
C18H21NO4S
Molecular Weight:
347.4286
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25mg
>98%(HPLC)
In Stock USA
United States
$87
- +
100mg
>98%(HPLC)
In Stock USA
United States
$155
- +
Product Description
Catalog Number:
AG001VVV
Chemical Name:
Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate
CAS Number:
161798-03-4
Molecular Formula:
C18H21NO4S
Molecular Weight:
347.4286
MDL Number:
MFCD13194811
IUPAC Name:
ethyl 2-[3-formyl-4-(2-methylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylate
InChI:
InChI=1S/C18H21NO4S/c1-5-22-18(21)16-12(4)19-17(24-16)13-6-7-15(14(8-13)9-20)23-10-11(2)3/h6-9,11H,5,10H2,1-4H3
InChI Key:
AIQMFFCWDAIGNV-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1sc(nc1C)c1ccc(c(c1)C=O)OCC(C)C
Properties
Complexity:
431  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.119g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
347.429g/mol
Monoisotopic Mass:
347.119g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
93.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Properties