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1871685-53-8 | 5-fluoro-2-(3-methyl-1,2-thiazol-5-yl)benzaldehyde
CAS No: 1871685-53-8 Catalog No: AG01C71E MDL No:MFCD31433652
Product Description
Catalog Number:
AG01C71E
Chemical Name:
5-fluoro-2-(3-methyl-1,2-thiazol-5-yl)benzaldehyde
CAS Number:
1871685-53-8
Molecular Formula:
C11H8FNOS
Molecular Weight:
221.2507
MDL Number:
MFCD31433652
IUPAC Name:
5-fluoro-2-(3-methyl-1,2-thiazol-5-yl)benzaldehyde
InChI:
InChI=1S/C11H8FNOS/c1-7-4-11(15-13-7)10-3-2-9(12)5-8(10)6-14/h2-6H,1H3
InChI Key:
YVVCCQOLYZXNTK-UHFFFAOYSA-N
SMILES:
O=Cc1cc(F)ccc1c1snc(c1)C
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.031g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.249g/mol
Monoisotopic Mass:
221.031g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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