Chemical ID: 6351749

CCS(=O)(=O)N1CCC(CC1)C
Chemical ID:
6351749
Name [?]:
1-ethylsulfonyl-4-methyl-piperidine
SMILES [?]:
CCS(=O)(=O)N1CCC(CC1)C
InChi [?]:
InChI=1/C8H17NO2S/c1-3-12(10,11)9-6-4-8(2)5-7-9/h8H,3-7H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,12,2,8,10,7,11,9,6,4,5,3/E:(4,5)(6,7)(10,11)/CRV:12.6/rA:12nCCSOONCCCCCC/rB:s1;s2;d3;d3;s3;s6;s7;s8;s9;s6s10;s9;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H17NO2S
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.52499
Area:347.061
Solvation:-2.15154
Coulombic:-5.34121
Bond Count [?]
All:12
Single:10
Double:2
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:191.292
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.39
LogP (Chemaxon):0.64

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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