Home Aldehydes 2-(4-methoxyphenoxymethyl)-1,3-thiazole-4-carbaldehyde

2-(4-methoxyphenoxymethyl)-1,3-thiazole-4-carbaldehyde

CAS No.:
1082576-05-3
Catalog Number:
AG019WUR
Molecular Formula:
C12H11NO3S
Molecular Weight:
249.2856
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Product Description
Catalog Number:
AG019WUR
Chemical Name:
2-(4-methoxyphenoxymethyl)-1,3-thiazole-4-carbaldehyde
CAS Number:
1082576-05-3
Molecular Formula:
C12H11NO3S
Molecular Weight:
249.2856
MDL Number:
MFCD11587924
IUPAC Name:
2-[(4-methoxyphenoxy)methyl]-1,3-thiazole-4-carbaldehyde
InChI:
InChI=1S/C12H11NO3S/c1-15-10-2-4-11(5-3-10)16-7-12-13-9(6-14)8-17-12/h2-6,8H,7H2,1H3
InChI Key:
FXJNQQGULPMGRN-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)OCc1scc(n1)C=O
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.046g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.284g/mol
Monoisotopic Mass:
249.046g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties