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Home > Aldehydes > 1197193-11-5
1197193-11-5 | Benzaldehyde, 2-fluoro-4-(methylsulfonyl)-
CAS No: 1197193-11-5 Catalog No: AG000PJ3 MDL No:MFCD13191594
Product Description
Catalog Number:
AG000PJ3
Chemical Name:
Benzaldehyde, 2-fluoro-4-(methylsulfonyl)-
CAS Number:
1197193-11-5
Molecular Formula:
C8H7FO3S
Molecular Weight:
202.2028
MDL Number:
MFCD13191594
IUPAC Name:
2-fluoro-4-methylsulfonylbenzaldehyde
InChI:
InChI=1S/C8H7FO3S/c1-13(11,12)7-3-2-6(5-10)8(9)4-7/h2-5H,1H3
InChI Key:
LXWRYLZWVVZZCM-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1F)S(=O)(=O)C
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.01g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.199g/mol
Monoisotopic Mass:
202.01g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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