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Home > Fluorides > 236739-02-9

236739-02-9

236739-02-9 | Benzene, 2,4-difluoro-1-(methylsulfonyl)-

CAS No: 236739-02-9 Catalog No: AG002O3R MDL No:MFCD03789188

Product Description

Catalog Number:
AG002O3R
Chemical Name:
Benzene, 2,4-difluoro-1-(methylsulfonyl)-
CAS Number:
236739-02-9
Molecular Formula:
C7H6F2O2S
Molecular Weight:
192.1831
MDL Number:
MFCD03789188
IUPAC Name:
2,4-difluoro-1-methylsulfonylbenzene
InChI:
InChI=1S/C7H6F2O2S/c1-12(10,11)7-3-2-5(8)4-6(7)9/h2-4H,1H3
InChI Key:
QERFJRMBVQTJAP-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)F)S(=O)(=O)C

Properties

Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.006g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.18g/mol
Monoisotopic Mass:
192.006g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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