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383143-90-6 | 4-(2,4-Dimethylphenyl)thiazole-2-carbaldehyde
CAS No: 383143-90-6 Catalog No: AG007AA2 MDL No:MFCD02665592
Product Description
Catalog Number:
AG007AA2
Chemical Name:
4-(2,4-Dimethylphenyl)thiazole-2-carbaldehyde
CAS Number:
383143-90-6
Molecular Formula:
C12H11NOS
Molecular Weight:
217.2868
MDL Number:
MFCD02665592
IUPAC Name:
4-(2,4-dimethylphenyl)-1,3-thiazole-2-carbaldehyde
InChI:
InChI=1S/C12H11NOS/c1-8-3-4-10(9(2)5-8)11-7-15-12(6-14)13-11/h3-7H,1-2H3
InChI Key:
JRCMCNLZDWPZTJ-UHFFFAOYSA-N
SMILES:
O=Cc1scc(n1)c1ccc(cc1C)C
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.056g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.286g/mol
Monoisotopic Mass:
217.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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