Chemical ID: 7677895

Cc1ccc2c(c1)[nH]c(n2)C(=O)O
Chemical ID:
7677895
Name [?]:
None
SMILES [?]:
Cc1ccc2c(c1)[nH]c(n2)C(=O)O
InChi [?]:
InChI=1/C9H8N2O2/c1-5-2-3-6-7(4-5)11-8(10-6)9(12)13/h2-4H,1H3,(H,10,11)(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,3,4,7,2,5,6,9,11,10,8,12,13/E:(12,13)/rA:13nCCCCCCCNCNCOO/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s5d9;s9;d11;s11;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H8N2O2
All Atoms:21
Heavy Atoms:13
Chiral Atoms:None
ZAP Information [?]
Total:6.61493
Area:335.499
Solvation:-1.77254
Coulombic:-46.9329
Bond Count [?]
All:14
Single:9
Double:5
Rotors:1
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:1.38
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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