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Home > Aldehydes > 885279-08-3
885279-08-3 | 2-(3-Ethylphenyl)thiazole-4-carbaldehyde
CAS No: 885279-08-3 Catalog No: AG00459E MDL No:MFCD06738369
Product Description
Catalog Number:
AG00459E
Chemical Name:
2-(3-Ethylphenyl)thiazole-4-carbaldehyde
CAS Number:
885279-08-3
Molecular Formula:
C12H11NOS
Molecular Weight:
217.2868
MDL Number:
MFCD06738369
IUPAC Name:
2-(3-ethylphenyl)-1,3-thiazole-4-carbaldehyde
InChI:
InChI=1S/C12H11NOS/c1-2-9-4-3-5-10(6-9)12-13-11(7-14)8-15-12/h3-8H,2H2,1H3
InChI Key:
OSCBSOZMXHNLDB-UHFFFAOYSA-N
SMILES:
CCc1cccc(c1)c1scc(n1)C=O
Properties
Complexity:
222
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:
3
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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