Chemical ID: 6918063

CN1C(=O)CC(C1=O)c2ccccc2
Chemical ID:
6918063
Name [?]:
1-methyl-3-phenyl-pyrrolidine-2,5-dione
SMILES [?]:
CN1C(=O)CC(C1=O)c2ccccc2
InChi [?]:
InChI=1/C11H11NO2/c1-12-10(13)7-9(11(12)14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3
InChi Info:
AuxInfo=1/0/N:1,12,11,13,10,14,5,9,6,3,7,2,4,8/E:(3,4)(5,6)/rA:14cCNCOCCCOCCCCCC/rB:s1;s2;d3;s3;s5;s2s6;d7;s6;s9;d10;s11;d12;d9s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H11NO2
All Atoms:25
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:6.04441
Area:352.271
Solvation:-2.76236
Coulombic:-24.3626
Bond Count [?]
All:15
Single:10
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:189.211
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.66
LogP (Chemaxon):0.95

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Descriptor Annotations

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