Chemical ID: 6045517

CC1(OC2C3COC(O3)C(C2O1)O)C
Chemical ID:
6045517
Name [?]:
None
SMILES [?]:
CC1(OC2C3COC(O3)C(C2O1)O)C
InChi [?]:
InChI=1/C9H14O5/c1-9(2)13-6-4-3-11-8(12-4)5(10)7(6)14-9/h4-8,10H,3H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,14,6,5,10,4,11,8,2,13,7,9,3,12/E:(1,2)/rA:14cCCOCCCOCOCCOOC/rB:s1;s2;s3;s4;s5;s6;s7;s5s8;s8;s4s10;s2s11;s10;s2;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H14O5
All Atoms:14
Heavy Atoms:14
Chiral Atoms:5
ZAP Information [?]
Total:3.91957
Area:331.438
Solvation:-4.36637
Coulombic:-53.1323
Bond Count [?]
All:16
Single:16
Double:0
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:202.204
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:-0.55
LogP (Chemaxon):0.16

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Descriptor Annotations

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