Home Sulfos 4-[3-(trifluoromethyl)-3H-diazirin-3-yl]benzene-1-sulfonyl chloride

4-[3-(trifluoromethyl)-3H-diazirin-3-yl]benzene-1-sulfonyl chloride

CAS No.:
2089731-83-7
Catalog Number:
AG01AM5Z
Molecular Formula:
C8H4ClF3N2O2S
Molecular Weight:
284.6428
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Product Description
Catalog Number:
AG01AM5Z
Chemical Name:
4-[3-(trifluoromethyl)-3H-diazirin-3-yl]benzene-1-sulfonyl chloride
CAS Number:
2089731-83-7
Molecular Formula:
C8H4ClF3N2O2S
Molecular Weight:
284.6428
MDL Number:
MFCD31559115
IUPAC Name:
4-[3-(trifluoromethyl)diazirin-3-yl]benzenesulfonyl chloride
InChI:
InChI=1S/C8H4ClF3N2O2S/c9-17(15,16)6-3-1-5(2-4-6)7(13-14-7)8(10,11)12/h1-4H
InChI Key:
CINGXRHPEXNFCE-UHFFFAOYSA-N
SMILES:
FC(C1(N=N1)c1ccc(cc1)S(=O)(=O)Cl)(F)F
Properties
Complexity:
429  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.963g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.637g/mol
Monoisotopic Mass:
283.963g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties