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Chemical ID: 5179170
Chemical ID:
5179170
Name [?]:
7-(1-ethoxyethyl)norcarane
SMILES [?]:
CCOC(C)C1C2C1CCCC2
InChi [?]:
InChI=1/C11H20O/c1-3-12-8(2)11-9-6-4-5-7-10(9)11/h8-11H,3-7H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,5,2,10,11,9,12,4,8,7,6,3/E:(4,5)(6,7)(9,10)/rA:12cCCOCCCCCCCCC/rB:s1;s2;s3;s4;s4;s6;s6s7;s8;s9;s10;s7s11;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H20O |
All Atoms: | 12 |
Heavy Atoms: | 12 |
Chiral Atoms: | 3 |
ZAP Information [?]
Total: | 7.37305 |
Area: | 354.449 |
Solvation: | -1.48818 |
Coulombic: | -9.28889 |
Bond Count [?]
All: | 13 |
Single: | 13 |
Double: | 0 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 168.276 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 1 |
XLogP: | 3.45 |
LogP (Chemaxon): | 2.43 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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