Chemical ID: 6692814

Cc1ccc2c(c1)nc(o2)C
Chemical ID:
6692814
Name [?]:
2,5-dimethylbenzooxazole
SMILES [?]:
Cc1ccc2c(c1)nc(o2)C
InChi [?]:
InChI=1/C9H9NO/c1-6-3-4-9-8(5-6)10-7(2)11-9/h3-5H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,11,3,4,7,2,9,6,5,8,10/rA:11nCCCCCCCNCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s5s9;s9;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H9NO
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.27221
Area:302.962
Solvation:-1.30184
Coulombic:-13.8504
Bond Count [?]
All:12
Single:8
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:147.174
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.88
LogP (Chemaxon):2.47

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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