Chemical ID: 4157632

CCC(C)OC(=O)C(C)Oc1ccc2c(cc(=O)oc2c1)C
Chemical ID:
4157632
Name [?]:
sec-butyl 2-(4-methyl-2-oxo-chromen-7-yl)oxypropanoate
SMILES [?]:
CCC(C)OC(=O)C(C)Oc1ccc2c(cc(=O)oc2c1)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H20O5
All Atoms:22
Heavy Atoms:22
Chiral Atoms:2
ZAP Information [?]
Total:8.84096
Area:519.012
Solvation:-4.13435
Coulombic:-46.2765
Bond Count [?]
All:23
Single:17
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:304.338
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:3.51
LogP (Chemaxon):3.66

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