Chemical ID: 4277671

Cc1cc2c(o1)ccc3c2non3
Chemical ID:
4277671
Name [?]:
None
SMILES [?]:
Cc1cc2c(o1)ccc3c2non3
InChi [?]:
InChI=1/C9H6N2O2/c1-5-4-6-8(12-5)3-2-7-9(6)11-13-10-7/h2-4H,1H3
InChi Info:
AuxInfo=1/0/N:1,8,7,3,2,4,9,5,10,13,11,6,12/rA:13nCCCCCOCCCCNON/rB:s1;d2;s3;d4;s2s5;s5;d7;s8;s4s9;d10;s11;d9s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H6N2O2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:5.88196
Area:320.725
Solvation:-2.13617
Coulombic:-8.92354
Bond Count [?]
All:15
Single:10
Double:5
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:174.156
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.06
LogP (Chemaxon):2.27

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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