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Chemical ID: 6681715
Chemical ID:
6681715
Name [?]:
2-(4a-methyl-8-methylene-decalin-2-yl)propan-2-ol
SMILES [?]:
CC12CCCC(=C)C1CC(CC2)C(C)(C)O
InChi [?]:
InChI=1/C15H26O/c1-11-6-5-8-15(4)9-7-12(10-13(11)15)14(2,3)16/h12-13,16H,1,5-10H2,2-4H3
InChi Info:
AuxInfo=1/0/N:7,14,15,1,4,5,11,3,12,9,6,10,8,13,2,16/E:(2,3)/rA:16cCCCCCCCCCCCCCCCO/rB:s1;s2;s3;s4;s5;d6;s2s6;s8;s9;s10;s2s11;s10;s13;s13;s13;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H26O |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 3 |
ZAP Information [?]
Total: | 8.37022 |
Area: | 389.438 |
Solvation: | -1.36574 |
Coulombic: | -19.7992 |
Bond Count [?]
All: | 17 |
Single: | 16 |
Double: | 1 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 222.366 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 1 |
XLogP: | 4.83 |
LogP (Chemaxon): | 3.45 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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