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Home > Aldehydes > 1398497-04-5
1398497-04-5 | 6-fluoro-3-methyl-1-benzothiophene-2-carbaldehyde
CAS No: 1398497-04-5 Catalog No: AG01DW07 MDL No:MFCD29578542
Product Description
Catalog Number:
AG01DW07
Chemical Name:
6-fluoro-3-methyl-1-benzothiophene-2-carbaldehyde
CAS Number:
1398497-04-5
Molecular Formula:
C10H7FOS
Molecular Weight:
194.2254
MDL Number:
MFCD29578542
IUPAC Name:
6-fluoro-3-methyl-1-benzothiophene-2-carbaldehyde
InChI:
InChI=1S/C10H7FOS/c1-6-8-3-2-7(11)4-9(8)13-10(6)5-12/h2-5H,1H3
InChI Key:
XGWVAQYKTCCPMK-UHFFFAOYSA-N
SMILES:
O=Cc1sc2c(c1C)ccc(c2)F
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.02g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.223g/mol
Monoisotopic Mass:
194.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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