Chemical ID: 5233975

C1C2C3C=CC(C2C(=O)O1)O3
Chemical ID:
5233975
Name [?]:
None
SMILES [?]:
C1C2C3C=CC(C2C(=O)O1)O3
InChi [?]:
InChI=1/C8H8O3/c9-8-7-4(3-10-8)5-1-2-6(7)11-5/h1-2,4-7H,3H2
InChi Info:
AuxInfo=1/0/N:4,5,1,2,3,6,7,8,9,10,11/rA:11cCCCCCCCCOOO/rB:s1;s2;s3;d4;s5;s2s6;s7;d8;s1s8;s3s6;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H8O3
All Atoms:11
Heavy Atoms:11
Chiral Atoms:4
ZAP Information [?]
Total:3.15872
Area:273.865
Solvation:-3.68791
Coulombic:-25.1501
Bond Count [?]
All:13
Single:11
Double:2
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:152.147
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.16
LogP (Chemaxon):-0.09

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Descriptor Annotations

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