Chemical ID: 4605814

c1cc(sc1)Cc2cccs2
Chemical ID:
4605814
Name [?]:
2-(2-thienylmethyl)thiophene
SMILES [?]:
c1cc(sc1)Cc2cccs2
InChi [?]:
InChI=1/C9H8S2/c1-3-8(10-5-1)7-9-4-2-6-11-9/h1-6H,7H2
InChi Info:
AuxInfo=1/0/N:1,9,2,8,5,10,6,3,7,4,11/E:(1,2)(3,4)(5,6)(8,9)(10,11)/rA:11nCCCSCCCCCCS/rB:s1;d2;s3;d1s4;s3;s6;d7;s8;d9;s7s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H8S2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:7.60603
Area:341.638
Solvation:-0.934926
Coulombic:-2.68022
Bond Count [?]
All:12
Single:8
Double:4
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:180.292
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.9
LogP (Chemaxon):2.61

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Descriptor Annotations

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