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Chemical ID: 6322314
Chemical ID:
6322314
Name [?]:
N-(2-furylmethyl)methanesulfonamide
SMILES [?]:
CS(=O)(=O)NCc1ccco1
InChi [?]:
InChI=1/C6H9NO3S/c1-11(8,9)7-5-6-3-2-4-10-6/h2-4,7H,5H2,1H3
InChi Info:
AuxInfo=1/0/N:1,9,8,10,6,7,5,3,4,11,2/E:(8,9)/CRV:11.6/rA:11nCSOONCCCCCO/rB:s1;d2;d2;s2;s5;s6;d7;s8;d9;s7s10;/rC:;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C6H9NO3S |
All Atoms: | 11 |
Heavy Atoms: | 11 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 4.23506 |
Area: | 330.507 |
Solvation: | -4.02762 |
Coulombic: | -14.8896 |
Bond Count [?]
All: | 11 |
Single: | 7 |
Double: | 4 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 175.207 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | -0.17 |
LogP (Chemaxon): | -0.4 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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