Chemical ID: 6605570

CCOC(=O)CCC(=O)O
Chemical ID:
6605570
Name [?]:
4-ethoxy-4-oxo-butanoic acid
SMILES [?]:
CCOC(=O)CCC(=O)O
InChi [?]:
InChI=1/C6H10O4/c1-2-10-6(9)4-3-5(7)8/h2-4H2,1H3,(H,7,8)
InChi Info:
AuxInfo=1/1/N:1,2,7,6,8,4,9,10,5,3/E:(7,8)/rA:10nCCOCOCCCOO/rB:s1;s2;s3;d4;s4;s6;s7;d8;s8;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H10O4
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:5.52559
Area:322.78
Solvation:-2.5439
Coulombic:-42.5148
Bond Count [?]
All:9
Single:7
Double:2
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:146.141
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:0.03
LogP (Chemaxon):0.0

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Descriptor Annotations

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