ChemDB: Chemical Search
Download
Chemical ID: 7655361
Chemical ID:
7655361
Name [?]:
None
SMILES [?]:
C#Cc1ccc(cc1)Oc2ccccc2
InChi [?]:
InChI=1/C14H10O/c1-2-12-8-10-14(11-9-12)15-13-6-4-3-5-7-13/h1,3-11H
InChi Info:
AuxInfo=1/0/N:1,2,13,12,14,11,15,4,8,5,7,3,10,6,9/E:(4,5)(6,7)(8,9)(10,11)/rA:15nCCCCCCCCOCCCCCC/rB:t1;s2;s3;d4;s5;d6;d3s7;s6;s9;s10;d11;s12;d13;d10s14;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H10O |
All Atoms: | 25 |
Heavy Atoms: | 15 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 7.80849 |
Area: | 380.255 |
Solvation: | -1.69787 |
Coulombic: | -12.2628 |
Bond Count [?]
All: | 16 |
Single: | 9 |
Double: | 6 |
Rotors: | 2 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 4.0 |
LogP (Chemaxon): | None |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|