Chemical ID: 4664055

c1ccc(cc1)c2cccs2
Chemical ID:
4664055
Name [?]:
2-phenylthiophene
SMILES [?]:
c1ccc(cc1)c2cccs2
InChi [?]:
InChI=1/C10H8S/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-8H
InChi Info:
AuxInfo=1/0/N:1,2,6,9,3,5,8,10,4,7,11/E:(2,3)(5,6)/rA:11nCCCCCCCCCCS/rB:s1;d2;s3;d4;d1s5;s4;d7;s8;d9;s7s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H8S
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:7.21189
Area:321.168
Solvation:-0.817308
Coulombic:-3.45582
Bond Count [?]
All:12
Single:7
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:160.237
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.99
LogP (Chemaxon):3.15

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Descriptor Annotations

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