Chemical ID: 7162580

Cc1c(c(n(n1)C)C)n2cnnn2
Chemical ID:
7162580
Name [?]:
1-(1,3,5-trimethylpyrazol-4-yl)tetrazole
SMILES [?]:
Cc1c(c(n(n1)C)C)n2cnnn2
InChi [?]:
InChI=1/C7H10N6/c1-5-7(6(2)12(3)9-5)13-4-8-10-11-13/h4H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,8,7,10,2,4,3,11,6,12,13,5,9/rA:13nCCCCNNCCNCNNN/rB:s1;s2;d3;s4;d2s5;s5;s4;s3;s9;d10;s11;s9d12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H10N6
All Atoms:23
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.30604
Area:339.767
Solvation:-2.18813
Coulombic:-7.31959
Bond Count [?]
All:14
Single:10
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:178.195
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:-0.14
LogP (Chemaxon):-0.61

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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