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Chemical ID: 5852097
Chemical ID:
5852097
Name [?]:
N-(2-hydroxyphenyl)methanesulfonamide
SMILES [?]:
CS(=O)(=O)Nc1ccccc1O
InChi [?]:
InChI=1/C7H9NO3S/c1-12(10,11)8-6-4-2-3-5-7(6)9/h2-5,8-9H,1H3
InChi Info:
AuxInfo=1/0/N:1,8,9,7,10,6,11,5,12,3,4,2/E:(10,11)/CRV:12.6/rA:12nCSOONCCCCCCO/rB:s1;d2;d2;s2;s5;s6;d7;s8;d9;d6s10;s11;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C7H9NO3S |
All Atoms: | 12 |
Heavy Atoms: | 12 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.1825 |
Area: | 328.003 |
Solvation: | -3.01758 |
Coulombic: | -26.0448 |
Bond Count [?]
All: | 12 |
Single: | 7 |
Double: | 5 |
Rotors: | 2 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 187.217 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 1.29 |
LogP (Chemaxon): | 0.27 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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