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Chemical ID: 6679330
Chemical ID:
6679330
Name [?]:
2,2,6,6-tetramethylcyclohexan-1-one
SMILES [?]:
CC1(CCCC(C1=O)(C)C)C
InChi [?]:
InChI=1/C10H18O/c1-9(2)6-5-7-10(3,4)8(9)11/h5-7H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,11,9,10,4,3,5,7,2,6,8/E:(1,2,3,4)(6,7)(9,10)/rA:11nCCCCCCCOCCC/rB:s1;s2;s3;s4;s5;s2s6;d7;s6;s6;s2;/rC:;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H18O |
All Atoms: | 11 |
Heavy Atoms: | 11 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.29015 |
Area: | 305.456 |
Solvation: | -1.34625 |
Coulombic: | -9.01913 |
Bond Count [?]
All: | 11 |
Single: | 10 |
Double: | 1 |
Rotors: | 0 |
Chiral: | 0 |
Rigid Segments: | 1 |
Chemical Properties
Molecular Weight: | 154.249 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 1 |
XLogP: | 1.91 |
LogP (Chemaxon): | 3.98 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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