Chemical ID: 4731426

c1ccc(cc1)Sc2cccs2
Chemical ID:
4731426
Name [?]:
2-phenylsulfanylthiophene
SMILES [?]:
c1ccc(cc1)Sc2cccs2
InChi [?]:
InChI=1/C10H8S2/c1-2-5-9(6-3-1)12-10-7-4-8-11-10/h1-8H
InChi Info:
AuxInfo=1/0/N:1,2,6,10,3,5,9,11,4,8,12,7/E:(2,3)(5,6)/rA:12nCCCCCCSCCCCS/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;d10;s8s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H8S2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:7.85804
Area:347.444
Solvation:-0.828066
Coulombic:-4.00826
Bond Count [?]
All:13
Single:8
Double:5
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:192.303
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.28
LogP (Chemaxon):4.15

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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