Chemical ID: 4254509

C1Cc2c(n[nH]c2C(=O)O)C1
Chemical ID:
4254509
Name [?]:
3,4-diazabicyclo[3.3.0]octa-1,4-diene-2-carboxylic acid
SMILES [?]:
C1Cc2c(n[nH]c2C(=O)O)C1
InChi [?]:
InChI=1/C7H8N2O2/c10-7(11)6-4-2-1-3-5(4)8-9-6/h1-3H2,(H,8,9)(H,10,11)
InChi Info:
AuxInfo=1/1/N:1,2,11,3,4,7,8,5,6,9,10/E:(10,11)/rA:11nCCCCNNCCOOC/rB:s1;s2;s3;d4;s5;d3s6;s7;d8;s8;s1s4;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H8N2O2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.46745
Area:297.515
Solvation:-1.97042
Coulombic:-36.6482
Bond Count [?]
All:12
Single:9
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:152.151
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:0.52
LogP (Chemaxon):0.42

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