Chemical ID: 5080717

C=C(CC(=O)O)C(=O)O
Chemical ID:
5080717
Name [?]:
3-methylenebutanedioic acid
SMILES [?]:
C=C(CC(=O)O)C(=O)O
InChi [?]:
InChI=1/C5H6O4/c1-3(5(8)9)2-4(6)7/h1-2H2,(H,6,7)(H,8,9)
InChi Info:
AuxInfo=1/1/N:1,3,2,4,7,5,6,8,9/E:(6,7)(8,9)/rA:9nCCCCOOCOO/rB:d1;s2;s3;d4;s4;s2;d7;s7;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C5H6O4
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:4.2746
Area:280.009
Solvation:-2.72562
Coulombic:-52.5169
Bond Count [?]
All:8
Single:5
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:130.099
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:-0.44
LogP (Chemaxon):0.03

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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