Chemical ID: 5184772

C1CC2C(C(C1O2)CO)CO
Chemical ID:
5184772
Name [?]:
[2-(hydroxymethyl)-7-oxabicyclo[2.2.1]hept-3-yl]methanol
SMILES [?]:
C1CC2C(C(C1O2)CO)CO
InChi [?]:
InChI=1/C8H14O3/c9-3-5-6(4-10)8-2-1-7(5)11-8/h5-10H,1-4H2
InChi Info:
AuxInfo=1/0/N:1,2,8,10,5,4,6,3,9,11,7/E:(1,2)(3,4)(5,6)(7,8)(9,10)/rA:11cCCCCCCOCOCO/rB:s1;s2;s3;s4;s1s5;s3s6;s5;s8;s4;s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H14O3
All Atoms:11
Heavy Atoms:11
Chiral Atoms:4
ZAP Information [?]
Total:3.68058
Area:307.061
Solvation:-3.99595
Coulombic:-40.5735
Bond Count [?]
All:12
Single:12
Double:0
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:158.195
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:-0.56
LogP (Chemaxon):-0.59

Name Annotations

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Descriptor Annotations

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