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Chemical ID: 4163616
Chemical ID:
4163616
Name [?]:
2-(4-methyl-1-cyclohex-3-enyl)propan-2-ol
SMILES [?]:
CC1=CCC(CC1)C(C)(C)O
InChi [?]:
InChI=1/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h4,9,11H,5-7H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,9,10,3,7,4,6,2,5,8,11/E:(2,3)/rA:11cCCCCCCCCCCO/rB:s1;d2;s3;s4;s5;s2s6;s5;s8;s8;s8;/rC:;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H18O |
All Atoms: | 11 |
Heavy Atoms: | 11 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 6.6157 |
Area: | 320.844 |
Solvation: | -1.40541 |
Coulombic: | -18.2674 |
Bond Count [?]
All: | 11 |
Single: | 10 |
Double: | 1 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 154.249 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 1 |
XLogP: | 2.37 |
LogP (Chemaxon): | 2.02 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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