Chemical ID: 5197697

CN(C)S(=O)(=O)Oc1ccc(cc1)N
Chemical ID:
5197697
Name [?]:
1-amino-4-(dimethylsulfamoyloxy)benzene
SMILES [?]:
CN(C)S(=O)(=O)Oc1ccc(cc1)N
InChi [?]:
InChI=1/C8H12N2O3S/c1-10(2)14(11,12)13-8-5-3-7(9)4-6-8/h3-6H,9H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,10,12,9,13,11,8,14,2,5,6,7,4/E:(1,2)(3,4)(5,6)(11,12)/CRV:14.6/rA:14nCNCSOOOCCCCCCN/rB:s1;s2;s2;d4;d4;s4;s7;s8;d9;s10;d11;d8s12;s11;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H12N2O3S
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.8232
Area:353.819
Solvation:-2.02227
Coulombic:-27.6064
Bond Count [?]
All:14
Single:9
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:216.259
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:0.28
LogP (Chemaxon):0.55

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Descriptor Annotations

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