Chemical ID: 4960492

C1CC2COCC(C1)C2O
Chemical ID:
4960492
Name [?]:
3-oxabicyclo[3.3.1]nonan-9-ol
SMILES [?]:
C1CC2COCC(C1)C2O
InChi [?]:
InChI=1/C8H14O2/c9-8-6-2-1-3-7(8)5-10-4-6/h6-9H,1-5H2
InChi Info:
AuxInfo=1/0/N:1,2,8,4,6,3,7,9,10,5/E:(2,3)(4,5)(6,7)/rA:10cCCCCOCCCCO/rB:s1;s2;s3;s4;s5;s6;s1s7;s3s7;s9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H14O2
All Atoms:10
Heavy Atoms:10
Chiral Atoms:2
ZAP Information [?]
Total:4.02428
Area:269.882
Solvation:-2.72278
Coulombic:-24.675
Bond Count [?]
All:11
Single:11
Double:0
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:142.196
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:0.68
LogP (Chemaxon):0.46

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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