Chemical ID: 4760598

Cc1ccc(cc1)S(=O)(=O)C=C
Chemical ID:
4760598
Name [?]:
1-methyl-4-vinylsulfonyl-benzene
SMILES [?]:
Cc1ccc(cc1)S(=O)(=O)C=C
InChi [?]:
InChI=1/C9H10O2S/c1-3-12(10,11)9-6-4-8(2)5-7-9/h3-7H,1H2,2H3
InChi Info:
AuxInfo=1/0/N:12,1,11,3,7,4,6,2,5,9,10,8/E:(4,5)(6,7)(10,11)/CRV:12.6/rA:12nCCCCCCCSOOCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;d8;s8;d11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H10O2S
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.74903
Area:341.51
Solvation:-1.78872
Coulombic:-5.5555
Bond Count [?]
All:12
Single:6
Double:6
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:182.24
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.34
LogP (Chemaxon):2.14

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Descriptor Annotations

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