Chemical ID: 5218748

CCOCC1C(C(C(C(O1)O)O)O)O
Chemical ID:
5218748
Name [?]:
6-(ethoxymethyl)tetrahydropyran-2,3,4,5-tetrol
SMILES [?]:
CCOCC1C(C(C(C(O1)O)O)O)O
InChi [?]:
InChI=1/C8H16O6/c1-2-13-3-4-5(9)6(10)7(11)8(12)14-4/h4-12H,2-3H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,4,5,6,7,8,9,14,13,12,11,3,10/rA:14cCCOCCCCCCOOOOO/rB:s1;s2;s3;s4;s5;s6;s7;s8;s5s9;s9;s8;s7;s6;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H16O6
All Atoms:14
Heavy Atoms:14
Chiral Atoms:5
ZAP Information [?]
Total:1.73253
Area:367.336
Solvation:-7.45087
Coulombic:-82.9579
Bond Count [?]
All:14
Single:14
Double:0
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:208.209
H-Bond Donors:4
H-Bond Acceptors:6
XLogP:-1.61
LogP (Chemaxon):-1.14

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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