Chemical ID: 6656528

CC(=O)N1c2ccccc2C(C1=O)(C)C
Chemical ID:
6656528
Name [?]:
1-acetyl-3,3-dimethyl-indolin-2-one
SMILES [?]:
CC(=O)N1c2ccccc2C(C1=O)(C)C
InChi [?]:
InChI=1/C12H13NO2/c1-8(14)13-10-7-5-4-6-9(10)12(2,3)11(13)15/h4-7H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,14,15,8,7,9,6,2,10,5,12,11,4,3,13/E:(2,3)/rA:15nCCONCCCCCCCCOCC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s10;s4s11;d12;s11;s11;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H13NO2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.23364
Area:358.681
Solvation:-1.73338
Coulombic:-25.5936
Bond Count [?]
All:16
Single:11
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:203.237
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.72
LogP (Chemaxon):1.92

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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