Chemical ID: 4164255

c1ccc(cc1)NC2=CC(=O)OC2
Chemical ID:
4164255
Name [?]:
4-anilino-5H-furan-2-one
SMILES [?]:
c1ccc(cc1)NC2=CC(=O)OC2
InChi [?]:
InChI=1/C10H9NO2/c12-10-6-9(7-13-10)11-8-4-2-1-3-5-8/h1-6,11H,7H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,5,9,13,4,8,10,7,11,12/E:(2,3)(4,5)/rA:13nCCCCCCNCCCOOC/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;d10;s10;s8s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H9NO2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:5.92787
Area:338.738
Solvation:-2.54059
Coulombic:-30.2903
Bond Count [?]
All:14
Single:9
Double:5
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:175.184
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.51
LogP (Chemaxon):0.75

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