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1857353-28-6 | 2-fluoro-3-(3-methyl-1,2-thiazol-5-yl)benzaldehyde
CAS No: 1857353-28-6 Catalog No: AG01C71G MDL No:MFCD30189452
Product Description
Catalog Number:
AG01C71G
Chemical Name:
2-fluoro-3-(3-methyl-1,2-thiazol-5-yl)benzaldehyde
CAS Number:
1857353-28-6
Molecular Formula:
C11H8FNOS
Molecular Weight:
221.2507
MDL Number:
MFCD30189452
IUPAC Name:
2-fluoro-3-(3-methyl-1,2-thiazol-5-yl)benzaldehyde
InChI:
InChI=1S/C11H8FNOS/c1-7-5-10(15-13-7)9-4-2-3-8(6-14)11(9)12/h2-6H,1H3
InChI Key:
VAXBMLNVWWWHND-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1F)c1snc(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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