Chemical ID: 4117449

c1cc(sc1Cl)Cl
Chemical ID:
4117449
Name [?]:
2,5-dichlorothiophene
SMILES [?]:
c1cc(sc1Cl)Cl
InChi [?]:
InChI=1/C4H2Cl2S/c5-3-1-2-4(6)7-3/h1-2H
InChi Info:
AuxInfo=1/0/N:1,2,5,3,6,7,4/E:(1,2)(3,4)(5,6)/rA:7nCCCSCClCl/rB:s1;d2;s3;d1s4;s5;s3;/rC:;;;;;;;

Chemical Details

Atom Count
Formula:C4H2Cl2S
All Atoms:7
Heavy Atoms:7
Chiral Atoms:0
ZAP Information [?]
Total:6.7417
Area:288.105
Solvation:-0.460927
Coulombic:-2.28737
Bond Count [?]
All:7
Single:5
Double:2
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:153.03
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.95
LogP (Chemaxon):2.6

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