Chemical ID: 6047816

CCOC(=O)c1ccc2c(c1)cn[nH]2
Chemical ID:
6047816
Name [?]:
ethyl 1H-indazole-5-carboxylate
SMILES [?]:
CCOC(=O)c1ccc2c(c1)cn[nH]2
InChi [?]:
InChI=1/C10H10N2O2/c1-2-14-10(13)7-3-4-9-8(5-7)6-11-12-9/h3-6H,2H2,1H3,(H,11,12)
InChi Info:
AuxInfo=1/1/N:1,2,7,8,11,12,6,10,9,4,13,14,5,3/rA:14nCCOCOCCCCCCCNN/rB:s1;s2;s3;d4;s4;s6;d7;s8;d9;d6s10;s10;d12;s9s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H10N2O2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.79357
Area:365.536
Solvation:-2.34482
Coulombic:-28.972
Bond Count [?]
All:15
Single:10
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:190.199
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.51
LogP (Chemaxon):1.66

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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