Chemical ID: 6657882

CCC(C)C(C)(CO)CO
Chemical ID:
6657882
Name [?]:
2-methyl-2-sec-butyl-propane-1,3-diol
SMILES [?]:
CCC(C)C(C)(CO)CO
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C8H18O2
All Atoms:10
Heavy Atoms:10
Chiral Atoms:1
ZAP Information [?]
Total:5.58377
Area:313.34
Solvation:-2.24974
Coulombic:-35.0353
Bond Count [?]
All:9
Single:9
Double:0
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:146.227
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:1.49
LogP (Chemaxon):1.57

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