Chemical ID: 4527431

Cc1ccc(c(c1)NC(=O)C=CC(=O)O)OC
Chemical ID:
4527431
Name [?]:
4-(2-methoxy-5-methyl-phenyl)amino-4-oxo-but-2-enoic acid
SMILES [?]:
Cc1ccc(c(c1)NC(=O)C=CC(=O)O)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H13NO4
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:5.94731
Area:413.662
Solvation:-4.39426
Coulombic:-53.9991
Bond Count [?]
All:17
Single:11
Double:6
Rotors:5
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:235.236
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.29
LogP (Chemaxon):1.8

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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