Chemical ID: 3964468

C1COCCC1CO
Chemical ID:
3964468
Name [?]:
tetrahydropyran-4-ylmethanol
SMILES [?]:
C1COCCC1CO
InChi [?]:
InChI=1/C6H12O2/c7-5-6-1-3-8-4-2-6/h6-7H,1-5H2
InChi Info:
AuxInfo=1/0/N:1,5,2,4,7,6,8,3/E:(1,2)(3,4)/rA:8nCCOCCCCO/rB:s1;s2;s3;s4;s1s5;s6;s7;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C6H12O2
All Atoms:8
Heavy Atoms:8
Chiral Atoms:0
ZAP Information [?]
Total:3.61209
Area:262.504
Solvation:-2.95051
Coulombic:-24.3041
Bond Count [?]
All:8
Single:8
Double:0
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:116.158
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:0.05
LogP (Chemaxon):-0.01

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Experimental Annotations

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Descriptor Annotations

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