Chemical ID: 5757263

c1cc2c(cc1O)cc(c(=N)o2)C#N
Chemical ID:
5757263
Name [?]:
6-hydroxy-2-imino-chromene-3-carbonitrile
SMILES [?]:
c1cc2c(cc1O)cc(c(=N)o2)C#N
InChi [?]:
InChI=1/C10H6N2O2/c11-5-7-3-6-4-8(13)1-2-9(6)14-10(7)12/h1-4,12-13H
InChi Info:
AuxInfo=1/0/N:1,2,8,5,13,4,9,6,3,10,14,11,7,12/rA:14nCCCCCCOCCCNOCN/rB:s1;d2;s3;d4;d1s5;s6;s4;d8;s9;w10;s3s10;s9;t13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H6N2O2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.02993
Area:352.545
Solvation:-2.7837
Coulombic:-39.0548
Bond Count [?]
All:15
Single:9
Double:5
Rotors:0
Chiral:1
Rigid Segments:1
Chemical Properties
Molecular Weight:186.167
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:1.42
LogP (Chemaxon):1.82

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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