Chemical ID: 6151950

C(CC(=O)[O-])CO
Chemical ID:
6151950
Name [?]:
4-hydroxybutanoate
SMILES [?]:
C(CC(=O)[O-])CO
InChi [?]:
InChI=1/C4H8O3/c5-3-1-2-4(6)7/h5H,1-3H2,(H,6,7)/p-1
InChi Info:
AuxInfo=1/1/N:1,2,6,3,7,4,5/E:(6,7)/rA:7nCCCOO-CO/rB:s1;s2;d3;s3;s1;s6;/rC:;;;;;;;

Chemical Details

Atom Count
Formula:C4H7O3-
All Atoms:7
Heavy Atoms:7
Chiral Atoms:0
ZAP Information [?]
Total:-37.9881
Area:257.542
Solvation:-44.4266
Coulombic:-14.2724
Bond Count [?]
All:6
Single:5
Double:1
Rotors:3
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:103.097
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:-1.08
LogP (Chemaxon):-0.29

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Descriptor Annotations

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