Chemical ID: 5093837

C(CCl)S(=O)(=O)O
Chemical ID:
5093837
Name [?]:
2-chloroethanesulfonic acid
SMILES [?]:
C(CCl)S(=O)(=O)O
InChi [?]:
InChI=1/C2H5ClO3S/c3-1-2-7(4,5)6/h1-2H2,(H,4,5,6)
InChi Info:
AuxInfo=1/1/N:2,1,3,5,6,7,4/E:(4,5,6)/CRV:7.6/rA:7nCCClSOOO/rB:s1;s2;s1;d4;d4;s4;/rC:;;;;;;;

Chemical Details

Atom Count
Formula:C2H5ClO3S
All Atoms:7
Heavy Atoms:7
Chiral Atoms:0
ZAP Information [?]
Total:4.76469
Area:275.069
Solvation:-2.11203
Coulombic:-13.5436
Bond Count [?]
All:6
Single:4
Double:2
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:144.578
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:-0.2
LogP (Chemaxon):-0.38

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