Chemical ID: 6919569

CN(C)C1CSSSSSC1
Chemical ID:
6919569
Name [?]:
N,N-dimethylpentathiocan-7-amine
SMILES [?]:
CN(C)C1CSSSSSC1
InChi [?]:
InChI=1/C5H11NS5/c1-6(2)5-3-7-9-11-10-8-4-5/h5H,3-4H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,5,11,4,2,6,10,7,9,8/E:(1,2)(3,4)(7,8)(9,10)/rA:11nCNCCCSSSSSC/rB:s1;s2;s2;s4;s5;s6;s7;s8;s9;s4s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C5H11NS5
All Atoms:22
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:8.26709
Area:360.833
Solvation:-0.753723
Coulombic:-5.68547
Bond Count [?]
All:11
Single:11
Double:0
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:245.478
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.88
LogP (Chemaxon):2.53

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