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Chemical ID: 7616782
Chemical ID:
7616782
Name [?]:
None
SMILES [?]:
CC1(CCC(=C2C13CCC(C3)C2(C)C)CO)C
InChi [?]:
InChI=1/C16H26O/c1-14(2)7-5-11(10-17)13-15(3,4)12-6-8-16(13,14)9-12/h12,17H,5-10H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,17,13,14,4,9,3,8,11,15,5,10,6,2,12,7,16/E:(1,2)(3,4)/rA:17cCCCCCCCCCCCCCCCOC/rB:s1;s2;s3;s4;d5;s2s6;s7;s8;s9;s7s10;s6s10;s12;s12;s5;s15;s2;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H26O |
All Atoms: | 43 |
Heavy Atoms: | 17 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 8.08072 |
Area: | 384.815 |
Solvation: | -1.53965 |
Coulombic: | -19.0337 |
Bond Count [?]
All: | 19 |
Single: | 18 |
Double: | 1 |
Rotors: | 1 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.11 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
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