Chemical ID: 4733833

Cc1ccc2c(c1)oc(=O)[nH]2
Chemical ID:
4733833
Name [?]:
6-methyl-3H-benzooxazol-2-one
SMILES [?]:
Cc1ccc2c(c1)oc(=O)[nH]2
InChi [?]:
InChI=1/C8H7NO2/c1-5-2-3-6-7(4-5)11-8(10)9-6/h2-4H,1H3,(H,9,10)
InChi Info:
AuxInfo=1/1/N:1,3,4,7,2,5,6,9,11,10,8/rA:11nCCCCCCCOCON/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s5s9;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H7NO2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.84981
Area:294.863
Solvation:-1.52177
Coulombic:-33.027
Bond Count [?]
All:12
Single:8
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:149.147
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.43
LogP (Chemaxon):2.69

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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