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Chemical ID: 7660237
Chemical ID:
7660237
Name [?]:
None
SMILES [?]:
CC1C2CC(C1(C)C)CC23OCCO3
InChi [?]:
InChI=1/C12H20O2/c1-8-10-6-9(11(8,2)3)7-12(10)13-4-5-14-12/h8-10H,4-7H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,7,8,12,13,4,9,2,5,3,6,10,11,14/E:(2,3)(4,5)(13,14)/rA:14cCCCCCCCCCCOCCO/rB:s1;s2;s3;s4;s2s5;s6;s6;s5;s3s9;s10;s11;s12;s10s13;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C12H20O2 |
All Atoms: | 34 |
Heavy Atoms: | 14 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 6.48348 |
Area: | 343.272 |
Solvation: | -2.09831 |
Coulombic: | -18.6217 |
Bond Count [?]
All: | 16 |
Single: | 16 |
Double: | 0 |
Rotors: | 0 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.1 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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Chemical Mix | Source | External ID | Descriptor | Value |
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