Chemical ID: 4914173

c1ccc(cc1)S(=O)(=O)c2ccccc2N
Chemical ID:
4914173
Name [?]:
2-phenylsulfonylaniline
SMILES [?]:
c1ccc(cc1)S(=O)(=O)c2ccccc2N
InChi [?]:
InChI=1/C12H11NO2S/c13-11-8-4-5-9-12(11)16(14,15)10-6-2-1-3-7-10/h1-9H,13H2
InChi Info:
AuxInfo=1/0/N:1,2,6,13,12,3,5,14,11,4,15,10,16,8,9,7/E:(2,3)(6,7)(14,15)/CRV:16.6/rA:16nCCCCCCSOOCCCCCCN/rB:s1;d2;s3;d4;d1s5;s4;d7;d7;s7;s10;d11;s12;d13;d10s14;s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H11NO2S
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.79198
Area:381.906
Solvation:-1.75566
Coulombic:-23.6713
Bond Count [?]
All:17
Single:9
Double:8
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:233.287
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.82
LogP (Chemaxon):2.74

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue